0 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)C 2230a_100009840616_200000210301 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)C 269982a_100009840616_200000210301 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)C 34a_100009840616_200000210301 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)[13CH3] 2230a_100009840616_200025704644 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)[13CH3] 269982a_100009840616_200025704644 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.8235 CC1CN(Cc2c1cc(cc2)Cl)[13CH3] 34a_100009840616_200025704644 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [0,0,0,0,0,0|0,0,4]=4 7 B14R2.8235 Cc1ccc2nc(nc(c2c1)O)C 271570a_203496583355_100013022803 [0,0,0,0,0,0|1,0,3]=4 8 B13R2.162 CC1CCNc2c1cc(cc2)O 271570a_203496583355_200013856564 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.162 NC1CCCc2c1cc(cc2)O 271570a_203496583355_100011742594 [1,0,0,0,0,0|3,0,0]=4 10 B13R2.162 NC1CCSc2c1cc(cc2)O 271570a_203496583355_100000744474 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.162 N[C@H]1CCOc2c1cc(cc2)O 271570a_203496583355_100020639276 [1,0,0,0,0,0|3,0,0]=4 12 B13R2.162 O=C1CCNc2c1cc(cc2)O 271570a_203496583355_100000697366 [1,0,0,0,0,0|1,0,2]=4 13 B13R2.162 Oc1ccc2c(c1)C(CCC2)O 271570a_203496583355_100011660633 [1,0,0,0,0,0|2,0,0]=3 14 B13R2.162 Oc1ccc2c(c1)C(CCO2)O 271570a_203496583355_100000760992 [1,0,0,0,0,0|2,0,0]=3 15 B13R2.328 CC1CN(Cc2c1cccc2)C 2230a_100015190047_200000210301 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.328 CC1CN(Cc2c1cccc2)C 269982a_100015190047_200000210301 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.328 CC1CN(Cc2c1cccc2)C 34a_100015190047_200000210301 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 2230a_100015190047_200025704644 [1,0,0,0,0,0|3,0,0]=4 19 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 269982a_100015190047_200025704644 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 34a_100015190047_200025704644 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.3683 CC1CCc2cc(ccc2N1)O 271570a_203496583355_100010333662 [1,0,0,0,0,0|1,0,0]=2 22 B13R2.3683 CC1Cc2ccc(cc2CN1)O 271570a_203496583355_200000706634 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.3683 CN1CCc2cc(ccc2C1)Br 2230a_100000686056_200000210301 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.3683 CN1CCc2cc(ccc2C1)Br 269982a_100000686056_200000210301 [1,0,0,0,0,0|3,0,0]=4 25 B13R2.3683 CN1CCc2cc(ccc2C1)Br 34a_100000686056_200000210301 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.3683 CN1CCc2cc(ccc2C1)Cl 2230a_100011273784_200000210301 [1,0,0,0,0,0|3,0,0]=4 27 B13R2.3683 CN1CCc2cc(ccc2C1)Cl 269982a_100011273784_200000210301 [1,0,0,0,0,0|3,0,0]=4 28 B13R2.3683 CN1CCc2cc(ccc2C1)Cl 34a_100011273784_200000210301 [1,0,0,0,0,0|3,0,0]=4 29 B13R2.3683 CN1CCc2cc(ccc2C1)F 2230a_100011273785_200000210301 [1,0,0,0,0,0|3,0,0]=4 30 B13R2.3683 CN1CCc2cc(ccc2C1)F 269982a_100011273785_200000210301 [1,0,0,0,0,0|3,0,0]=4 31 B13R2.3683 CN1CCc2cc(ccc2C1)F 34a_100011273785_200000210301 [1,0,0,0,0,0|3,0,0]=4 32 B13R2.3683 CN1CCc2cc(ccc2C1)O 2230a_100000077532_200000210301 [1,0,0,0,0,0|3,0,0]=4 33 B13R2.3683 CN1CCc2cc(ccc2C1)O 269982a_100000077532_200000210301 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.3683 CN1CCc2cc(ccc2C1)O 34a_100000077532_200000210301 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.3683 Cc1ccc2c(c1)CCN(C2)C 2230a_100000718575_200000210301 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.3683 Cc1ccc2c(c1)CCN(C2)C 269982a_100000718575_200000210301 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.3683 Cc1ccc2c(c1)CCN(C2)C 34a_100000718575_200000210301 [1,0,0,0,0,0|2,0,0]=3 38 B13R2.3683 Cc1ccc2c(c1)CCN(C2)[13CH3] 2230a_100000718575_200025704644 [1,0,0,0,0,0|2,0,0]=3 39 B13R2.3683 Cc1ccc2c(c1)CCN(C2)[13CH3] 269982a_100000718575_200025704644 [1,0,0,0,0,0|2,0,0]=3 40 B13R2.3683 Cc1ccc2c(c1)CCN(C2)[13CH3] 34a_100000718575_200025704644 [1,0,0,0,0,0|2,0,0]=3 41 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [1,0,0,0,0,0|2,0,1]=4 42 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Br 2230a_100000686056_200025704644 [1,0,0,0,0,0|3,0,0]=4 43 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Br 269982a_100000686056_200025704644 [1,0,0,0,0,0|3,0,0]=4 44 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Br 34a_100000686056_200025704644 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Cl 2230a_100011273784_200025704644 [1,0,0,0,0,0|3,0,0]=4 46 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Cl 269982a_100011273784_200025704644 [1,0,0,0,0,0|3,0,0]=4 47 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)Cl 34a_100011273784_200025704644 [1,0,0,0,0,0|3,0,0]=4 48 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)F 2230a_100011273785_200025704644 [1,0,0,0,0,0|3,0,0]=4 49 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)F 269982a_100011273785_200025704644 [1,0,0,0,0,0|3,0,0]=4 50 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)F 34a_100011273785_200025704644 [1,0,0,0,0,0|3,0,0]=4 51 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)O 2230a_100000077532_200025704644 [1,0,0,0,0,0|3,0,0]=4 52 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)O 269982a_100000077532_200025704644 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.3683 [13CH3]N1CCc2cc(ccc2C1)O 34a_100000077532_200025704644 [1,0,0,0,0,0|3,0,0]=4 54 B13R1.19 CC(CC#N)Nc1ccc(cc1)Br 2230a_100000210018_100009813641 [0,0,1,0,0,0|2,0,1]=4 55 B13R1.19 CC(CC#N)Nc1ccc(cc1)Cl 2230a_100000210052_100009813641 [0,0,1,0,0,0|2,0,1]=4 56 B13R1.19 CC(CCO)Nc1ccc(cc1)Br 2230a_100000210018_100009893172 [0,0,1,0,0,0|1,0,0]=2 57 B13R1.19 CC(CCO)Nc1ccc(cc1)Br 34a_100000210018_100009893172 [0,0,1,0,0,0|1,0,0]=2 58 B13R1.19 CC(CCO)Nc1ccc(cc1)Cl 2230a_100000210052_100009893172 [0,0,1,0,0,0|1,0,0]=2 59 B13R1.19 CC(CCO)Nc1ccc(cc1)Cl 34a_100000210052_100009893172 [0,0,1,0,0,0|1,0,0]=2 60 B13R1.19 CC(CCO)Nc1ccc(cc1)F 34a_100000185862_100009893172 [0,0,1,0,0,0|1,0,0]=2 61 B13R1.19 CC(CCO)Nc1ccc(cc1)I 34a_100000185761_100009893172 [0,0,1,0,0,0|1,0,0]=2 62 B13R1.19 CC(CCO)Nc1ccc(cc1)O 34a_100000185829_100009893172 [0,0,1,0,0,0|1,0,0]=2 63 B13R1.19 CC(CCO)Oc1ccc(=O)[nH]c1 34a_100000075641_100009893172 [0,0,1,0,0,0|3,0,0]=4 64 B13R1.19 CC(CCO)Oc1ccc(cc1)Br 34a_100000185759_100009893172 [0,0,1,0,0,0|2,0,0]=3 65 B13R1.19 CC(CCO)Oc1ccc(cc1)Br 7a_100000185759_100009893172 [0,0,1,0,0,0|2,0,0]=3 66 B13R1.19 CC(CCO)Oc1ccc(cc1)Cl 34a_100000210216_100009893172 [0,0,1,0,0,0|2,0,0]=3 67 B13R1.19 CC(CCO)Oc1ccc(cc1)Cl 7a_100000210216_100009893172 [0,0,1,0,0,0|2,0,0]=3 68 B13R1.19 CC(CCO)Oc1ccc(cc1)F 34a_100000210339_100009893172 [0,0,1,0,0,0|2,0,0]=3 69 B13R1.19 CC(CCO)Oc1ccc(cc1)I 34a_100000212066_100009893172 [0,0,1,0,0,0|2,0,0]=3 70 B13R1.19 CC(CCO)Oc1ccc(cc1)I 7a_100000212066_100009893172 [0,0,1,0,0,0|2,0,0]=3 71 B13R1.19 CC(CCO)Oc1ccc(cc1)N 34a_100000185829_100009893172 [0,0,1,0,0,0|2,0,0]=3 72 B13R1.19 CC(CCO)Oc1ccc(cn1)Cl 34a_100011215309_100009893172 [0,0,1,0,0,0|3,0,0]=4 73 B13R1.19 CC(CCO)Oc1ccc(cn1)F 34a_100000742473_100009893172 [0,0,1,0,0,0|3,0,0]=4 74 B13R1.19 CC(CCO)Oc1ccc(cn1)N 34a_100000729260_100009893172 [0,0,1,0,0,0|3,0,0]=4 75 B13R1.19 CC(CCO)Oc1ccc(nc1)Br 34a_100000685995_100009893172 [0,0,1,0,0,0|3,0,0]=4 76 B13R1.19 CC(CCO)Oc1ccc(nc1)Br 7a_100000685995_100009893172 [0,0,1,0,0,0|3,0,0]=4 77 B13R1.19 CC(CCO)Oc1ccc(nc1)Cl 34a_100000744096_100009893172 [0,0,1,0,0,0|3,0,0]=4 78 B13R1.19 CC(CCO)Oc1ccc(nc1)Cl 7a_100000744096_100009893172 [0,0,1,0,0,0|3,0,0]=4 79 B13R1.19 CC(CCO)Oc1ccc(nc1)F 34a_100000688820_100009893172 [0,0,1,0,0,0|3,0,0]=4 80 B13R1.19 CC(CCO)Oc1ccc(nc1)F 7a_100000688820_100009893172 [0,0,1,0,0,0|3,0,0]=4 81 B13R1.19 CC(CCO)Oc1ccc(nc1)I 34a_100000687607_100009893172 [0,0,1,0,0,0|3,0,0]=4 82 B13R1.19 CC(CCO)Oc1ccc(nc1)I 7a_100000687607_100009893172 [0,0,1,0,0,0|3,0,0]=4 83 B13R1.19 CC(CCO)Oc1ccc(nc1)N 34a_100015188713_100009893172 [0,0,1,0,0,0|3,0,0]=4 84 B13R1.19 CC(CCO)Oc1ccc(nc1)N 7a_100015188713_100009893172 [0,0,1,0,0,0|3,0,0]=4 85 B13R1.19 CC(CCO)Sc1cc[n+](cc1)[O-] 62a_100009893172_100000039755 [0,0,1,0,0,0|3,0,0]=4 86 B13R1.19 CC(CCO)Sc1ccc(=O)[nH]c1 62a_100000212171_100009893172 [0,0,1,0,0,0|3,0,0]=4 87 B13R1.19 CC(CCO)Sc1ccc(=O)[nH]c1 62a_100009893172_100000212171 [0,0,1,0,0,0|3,0,0]=4 88 B13R1.19 CC(CCO)Sc1ccc(cc1)Br 62a_100000752885_100009893172 [0,0,1,0,0,0|2,0,0]=3 89 B13R1.19 CC(CCO)Sc1ccc(cc1)Br 62a_100009893172_100000752885 [0,0,1,0,0,0|2,0,0]=3 90 B13R1.19 CC(CCO)Sc1ccc(cc1)Cl 62a_100000755918_100009893172 [0,0,1,0,0,0|2,0,0]=3 91 B13R1.19 CC(CCO)Sc1ccc(cc1)Cl 62a_100009893172_100000755918 [0,0,1,0,0,0|2,0,0]=3 92 B13R1.19 CC(CCO)Sc1ccc(cc1)F 62a_100000211213_100009893172 [0,0,1,0,0,0|2,0,0]=3 93 B13R1.19 CC(CCO)Sc1ccc(cc1)F 62a_100009893172_100000211213 [0,0,1,0,0,0|2,0,0]=3 94 B13R1.19 CC(CCO)Sc1ccc(cc1)N 62a_100000185761_100009893172 [0,0,1,0,0,0|2,0,0]=3 95 B13R1.19 CC(CCO)Sc1ccc(cc1)N 62a_100009893172_100000185761 [0,0,1,0,0,0|2,0,0]=3 96 B13R1.19 CC(CCO)Sc1ccc(cc1)O 62a_100009893172_100000185759 [0,0,1,0,0,0|2,0,0]=3 97 B13R1.19 CC(CCO)Sc1ccc(cn1)Br 62a_100000686858_100009893172 [0,0,1,0,0,0|3,0,0]=4 98 B13R1.19 CC(CCO)Sc1ccc(cn1)Br 62a_100009893172_100000686858 [0,0,1,0,0,0|3,0,0]=4 99 B13R1.19 CC(CCO)Sc1ccc(cn1)Cl 62a_100009893172_100011356976 [0,0,1,0,0,0|3,0,0]=4 100 B13R1.19 CC(CCO)Sc1ccc(cn1)Cl 62a_100011356976_100009893172 [0,0,1,0,0,0|3,0,0]=4 101 B13R1.19 CC(CCO)Sc1ccc(cn1)F 62a_100000744514_100009893172 [0,0,1,0,0,0|3,0,0]=4 102 B13R1.19 CC(CCO)Sc1ccc(cn1)F 62a_100009893172_100000744514 [0,0,1,0,0,0|3,0,0]=4 103 B13R1.19 CC(CCO)Sc1ccc(cn1)N 62a_100000737798_100009893172 [0,0,1,0,0,0|3,0,0]=4 104 B13R1.19 CC(CCO)Sc1ccc(cn1)N 62a_100009893172_100000737798 [0,0,1,0,0,0|3,0,0]=4 105 B13R1.19 CC(CCO)Sc1ccc(cn1)O 62a_100000685995_100009893172 [0,0,1,0,0,0|3,0,0]=4 106 B13R1.19 CC(CCO)Sc1ccc(cn1)O 62a_100009893172_100000744096 [0,0,1,0,0,0|3,0,0]=4 107 B13R1.19 CC(CCO)Sc1ccc(nc1)Br 62a_100009814638_100009893172 [0,0,1,0,0,0|3,0,0]=4 108 B13R1.19 CC(CCO)Sc1ccc(nc1)Br 62a_100009893172_100009814638 [0,0,1,0,0,0|3,0,0]=4 109 B13R1.19 CC(CCO)Sc1ccc(nc1)Cl 62a_100000034144_100009893172 [0,0,1,0,0,0|3,0,0]=4 110 B13R1.19 CC(CCO)Sc1ccc(nc1)Cl 62a_100009893172_100000034144 [0,0,1,0,0,0|3,0,0]=4 111 B13R1.19 CC(CCO)Sc1ccc(nc1)F 62a_100000042367_100009893172 [0,0,1,0,0,0|3,0,0]=4 112 B13R1.19 CC(CCO)Sc1ccc(nc1)F 62a_100009893172_100000042367 [0,0,1,0,0,0|3,0,0]=4 113 B13R1.19 CC(CCO)Sc1ccc(nc1)N 62a_100000187370_100009893172 [0,0,1,0,0,0|3,0,0]=4 114 B13R1.19 CC(CCO)Sc1ccc(nc1)N 62a_100009893172_100000187370 [0,0,1,0,0,0|3,0,0]=4 115 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211992 [0,0,1,0,0,0|2,0,1]=4 116 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211992 [0,0,1,0,0,0|2,0,1]=4 117 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211992 [0,0,1,0,0,0|2,0,1]=4 118 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211992 [0,0,1,0,0,0|2,0,1]=4 119 B13R1.19 CCCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000766640 [0,0,1,0,0,0|2,0,0]=3 120 B13R1.19 CCCC(C)Nc1ccc(cc1)Br 34a_100000210018_100000766640 [0,0,1,0,0,0|2,0,0]=3 121 B13R1.19 CCCC(C)Nc1ccc(cc1)C 34a_100000124888_100000766640 [0,0,1,0,0,0|1,0,0]=2 122 B13R1.19 CCCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000766640 [0,0,1,0,0,0|2,0,0]=3 123 B13R1.19 CCCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000766640 [0,0,1,0,0,0|2,0,0]=3 124 B13R1.19 CCCC(C)Nc1ccc(cc1)F 34a_100000185862_100000766640 [0,0,1,0,0,0|2,0,0]=3 125 B13R1.19 CCCC(C)Nc1ccc(cc1)I 34a_100000185761_100000766640 [0,0,1,0,0,0|2,0,0]=3 126 B13R1.19 CCCC(C)Nc1ccc(cc1)O 34a_100000185829_100000766640 [0,0,1,0,0,0|2,0,0]=3 127 B13R1.19 CCCC(C)Nc1ccc(cn1)Br 27a_100000741246_100000686858 [0,0,1,0,0,0|3,0,0]=4 128 B13R1.19 CCCC(C)Nc1ccc(nn1)C 27a_100000741246_100000744512 [0,0,1,0,0,0|3,0,0]=4 129 B13R1.19 CCCC(C)Nc1cnc(cn1)C 27a_100000741246_100000074397 [0,0,1,0,0,0|3,0,0]=4 130 B13R1.19 CCCC(C)Nc1ncc(cn1)C 27a_100000741246_100000061069 [0,0,1,0,0,0|3,0,0]=4 131 B13R1.19 CCCC(C)Oc1ccc(cc1)Br 34a_100000185759_100000766640 [0,0,1,0,0,0|3,0,0]=4 132 B13R1.19 CCCC(C)Oc1ccc(cc1)Br 7a_100000185759_100000766640 [0,0,1,0,0,0|3,0,0]=4 133 B13R1.19 CCCC(C)Oc1ccc(cc1)C 34a_100000210336_100000766640 [0,0,1,0,0,0|2,0,0]=3 134 B13R1.19 CCCC(C)Oc1ccc(cc1)C 7a_100000210336_100000766640 [0,0,1,0,0,0|2,0,0]=3 135 B13R1.19 CCCC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000766640 [0,0,1,0,0,0|3,0,0]=4 136 B13R1.19 CCCC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000766640 [0,0,1,0,0,0|3,0,0]=4 137 B13R1.19 CCCC(C)Oc1ccc(cc1)F 34a_100000210339_100000766640 [0,0,1,0,0,0|3,0,0]=4 138 B13R1.19 CCCC(C)Oc1ccc(cc1)I 34a_100000212066_100000766640 [0,0,1,0,0,0|3,0,0]=4 139 B13R1.19 CCCC(C)Oc1ccc(cc1)I 7a_100000212066_100000766640 [0,0,1,0,0,0|3,0,0]=4 140 B13R1.19 CCCC(C)Oc1ccc(cc1)N 34a_100000185829_100000766640 [0,0,1,0,0,0|3,0,0]=4 141 B13R1.19 CCCC(C)Oc1ccc(cn1)C 34a_100000759353_100000766640 [0,0,1,0,0,0|3,0,0]=4 142 B13R1.19 CCCC(C)Oc1ccc(nc1)C 34a_100000745506_100000766640 [0,0,1,0,0,0|3,0,0]=4 143 B13R1.19 CCCC(C)Oc1ccc(nc1)C 7a_100000745506_100000766640 [0,0,1,0,0,0|3,0,0]=4 144 B13R1.19 CCCC(C)Sc1ccc(cc1)Br 62a_100000752885_100000766640 [0,0,1,0,0,0|3,0,0]=4 145 B13R1.19 CCCC(C)Sc1ccc(cc1)Br 62a_100000766640_100000752885 [0,0,1,0,0,0|3,0,0]=4 146 B13R1.19 CCCC(C)Sc1ccc(cc1)C 62a_100000186775_100000766640 [0,0,1,0,0,0|2,0,0]=3 147 B13R1.19 CCCC(C)Sc1ccc(cc1)C 62a_100000766640_100000186775 [0,0,1,0,0,0|2,0,0]=3 148 B13R1.19 CCCC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000766640 [0,0,1,0,0,0|3,0,0]=4 149 B13R1.19 CCCC(C)Sc1ccc(cc1)Cl 62a_100000766640_100000755918 [0,0,1,0,0,0|3,0,0]=4 150 B13R1.19 CCCC(C)Sc1ccc(cc1)F 62a_100000211213_100000766640 [0,0,1,0,0,0|3,0,0]=4 151 B13R1.19 CCCC(C)Sc1ccc(cc1)F 62a_100000766640_100000211213 [0,0,1,0,0,0|3,0,0]=4 152 B13R1.19 CCCC(C)Sc1ccc(cc1)N 62a_100000185761_100000766640 [0,0,1,0,0,0|3,0,0]=4 153 B13R1.19 CCCC(C)Sc1ccc(cc1)N 62a_100000766640_100000185761 [0,0,1,0,0,0|3,0,0]=4 154 B13R1.19 CCCC(C)Sc1ccc(cc1)O 62a_100000766640_100000185759 [0,0,1,0,0,0|3,0,0]=4 155 B13R1.19 CCCC(C)Sc1ccc(cn1)C 62a_100000766640_100000754016 [0,0,1,0,0,0|3,0,0]=4 156 B13R1.19 CCCC(C)Sc1ccc(cn1)C 62a_100011192072_100000766640 [0,0,1,0,0,0|3,0,0]=4 157 B13R1.19 CCCC(C)Sc1ccc(nc1)C 62a_100000751577_100000766640 [0,0,1,0,0,0|3,0,0]=4 158 B13R1.19 CCCC(C)Sc1ccc(nc1)C 62a_100000766640_100000751577 [0,0,1,0,0,0|3,0,0]=4 159 B13R1.19 CCCN(C)Cc1ccc(cc1)C 2230a_100000186941_200000210301 [0,0,1,0,0,0|3,0,0]=4 160 B13R1.19 CCCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210303 [0,0,1,0,0,0|3,0,0]=4 161 B13R1.19 CCCN(C)Cc1ccc(cc1)C 2230a_100000747261_100000210814 [0,0,1,0,0,0|3,0,0]=4 162 B13R1.19 CCCN(C)Cc1ccc(cc1)C 269982a_100000186941_200000210301 [0,0,1,0,0,0|3,0,0]=4 163 B13R1.19 CCCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000210303 [0,0,1,0,0,0|3,0,0]=4 164 B13R1.19 CCCN(C)Cc1ccc(cc1)C 269982a_100000747261_100000210814 [0,0,1,0,0,0|3,0,0]=4 165 B13R1.19 CCCN(C)Cc1ccc(cc1)C 26a_100000747261_200020625495 [0,0,1,0,0,0|3,0,0]=4 166 B13R1.19 CCCN(C)Cc1ccc(cc1)C 270004a_100000747261_100000211033 [0,0,1,0,0,0|3,0,0]=4 167 B13R1.19 CCCN(C)Cc1ccc(cc1)C 34a_100000186941_200000210301 [0,0,1,0,0,0|3,0,0]=4 168 B13R1.19 CCCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210303 [0,0,1,0,0,0|3,0,0]=4 169 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)C 2230a_100000186941_200025704644 [0,0,1,0,0,0|3,0,0]=4 170 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)C 269982a_100000186941_200025704644 [0,0,1,0,0,0|3,0,0]=4 171 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)C 34a_100000186941_200025704644 [0,0,1,0,0,0|3,0,0]=4 172 B13R1.19 CCNC(C)Cc1ccc(cc1)C 270004a_100015525214_100000751045 [0,0,1,0,0,0|3,0,0]=4 173 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000180866_100000211926 [0,0,1,0,0,0|3,0,0]=4 174 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000186819_200000210301 [0,0,1,0,0,0|3,0,0]=4 175 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000210263_100011217064 [0,0,1,0,0,0|3,0,0]=4 176 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000180866_100000211926 [0,0,1,0,0,0|3,0,0]=4 177 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000186819_200000210301 [0,0,1,0,0,0|3,0,0]=4 178 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000210263_100011217064 [0,0,1,0,0,0|3,0,0]=4 179 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 26a_100000210263_100000185759 [0,0,1,0,0,0|3,0,0]=4 180 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 270004a_100000210263_100000186029 [0,0,1,0,0,0|3,0,0]=4 181 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 34a_100000186819_200000210301 [0,0,1,0,0,0|3,0,0]=4 182 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 2230a_100000184517_100000211926 [0,0,1,0,0,0|3,0,0]=4 183 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 2230a_100000210263_100000694040 [0,0,1,0,0,0|3,0,0]=4 184 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 269982a_100000184517_100000211926 [0,0,1,0,0,0|3,0,0]=4 185 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 269982a_100000210263_100000187161 [0,0,1,0,0,0|3,0,0]=4 186 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 270004a_100000210263_100000189385 [0,0,1,0,0,0|3,0,0]=4 187 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 34a_100000184517_100000211926 [0,0,1,0,0,0|3,0,0]=4 188 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100000184576_100000211926 [0,0,1,0,0,0|3,0,0]=4 189 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100000210263_100000198546 [0,0,1,0,0,0|3,0,0]=4 190 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100015183715_200000210301 [0,0,1,0,0,0|3,0,0]=4 191 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100000184576_100000211926 [0,0,1,0,0,0|3,0,0]=4 192 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100000210263_100000198546 [0,0,1,0,0,0|3,0,0]=4 193 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100015183715_200000210301 [0,0,1,0,0,0|3,0,0]=4 194 B13R1.19 CN(CCO)Cc1ccc(cc1)F 270004a_100000210263_100000210084 [0,0,1,0,0,0|3,0,0]=4 195 B13R1.19 CN(CCO)Cc1ccc(cc1)F 34a_100000184576_100000211926 [0,0,1,0,0,0|3,0,0]=4 196 B13R1.19 CN(CCO)Cc1ccc(cc1)F 34a_100015183715_200000210301 [0,0,1,0,0,0|3,0,0]=4 197 B13R1.19 CN(CCO)Cc1ccc(cc1)I 2230a_100000210263_100000189116 [0,0,1,0,0,0|3,0,0]=4 198 B13R1.19 CN(CCO)Cc1ccc(cc1)I 269982a_100000210263_100000189116 [0,0,1,0,0,0|3,0,0]=4 199 B13R1.19 CN(CCO)Cc1ccc(cc1)O 2230a_100000207500_100000211926 [0,0,1,0,0,0|3,0,0]=4 200 B13R1.19 CN(CCO)Cc1ccc(cc1)O 269982a_100000207500_100000211926 [0,0,1,0,0,0|3,0,0]=4 201 B13R1.19 CNCC(C)Oc1ccc(cc1)C 2230a_100000763606_200000210301 [0,0,1,0,0,0|3,0,0]=4 202 B13R1.19 CNCC(C)Oc1ccc(cc1)C 34a_100000763606_200000210301 [0,0,1,0,0,0|3,0,0]=4 203 B13R1.19 COCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000765312 [0,0,1,0,0,0|3,0,0]=4 204 B13R1.19 COCC(C)Nc1ccc(cc1)Br 34a_100000210018_100000765312 [0,0,1,0,0,0|3,0,0]=4 205 B13R1.19 COCC(C)Nc1ccc(cc1)C 34a_100000124888_100000765312 [0,0,1,0,0,0|2,0,0]=3 206 B13R1.19 COCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000765312 [0,0,1,0,0,0|3,0,0]=4 207 B13R1.19 COCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000765312 [0,0,1,0,0,0|3,0,0]=4 208 B13R1.19 COCC(C)Nc1ccc(cc1)F 34a_100000185862_100000765312 [0,0,1,0,0,0|3,0,0]=4 209 B13R1.19 COCC(C)Nc1ccc(cc1)I 34a_100000185761_100000765312 [0,0,1,0,0,0|3,0,0]=4 210 B13R1.19 COCC(C)Nc1ccc(cc1)O 34a_100000185829_100000765312 [0,0,1,0,0,0|3,0,0]=4 211 B13R1.19 COCC(C)Oc1ccc(cc1)C 34a_100000210336_100000765312 [0,0,1,0,0,0|3,0,0]=4 212 B13R1.19 COCC(C)Oc1ccc(cc1)C 7a_100000210336_100000765312 [0,0,1,0,0,0|3,0,0]=4 213 B13R1.19 COCC(C)Sc1ccc(cc1)C 62a_100000186775_100000765312 [0,0,1,0,0,0|3,0,0]=4 214 B13R1.19 COCC(C)Sc1ccc(cc1)C 62a_100000765312_100000186775 [0,0,1,0,0,0|3,0,0]=4 215 B13R1.19 C[C@H](CCO)Nc1ccc(cn1)Br 27a_100000706166_100000686858 [0,0,1,0,0,0|2,0,0]=3 216 B13R1.19 C[C@H](CCO)Nc1cnc(cn1)Br 27a_100000706166_100010187541 [0,0,1,0,0,0|3,0,0]=4 217 B13R1.19 C[C@H](CCO)Nc1cnc(cn1)F 27a_100000706166_100009856528 [0,0,1,0,0,0|3,0,0]=4 218 B13R1.19 C[C@H](CCO)Nc1ncc(cn1)Br 27a_100000706166_100000690281 [0,0,1,0,0,0|3,0,0]=4 219 B13R1.19 C[C@H](CCO)Nc1ncc(cn1)Cl 27a_100000706166_100011356929 [0,0,1,0,0,0|3,0,0]=4 220 B13R1.19 C[C@H](CCO)Nc1ncc(cn1)F 27a_100000706166_100000685220 [0,0,1,0,0,0|3,0,0]=4 221 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100000212244_100000211926 [0,0,1,0,0,0|2,0,1]=4 222 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000210814 [0,0,1,0,0,0|2,0,1]=4 223 B13R1.19 Cc1ccc(cc1)CN(C)CCF 2230a_100000744650_100011217306 [0,0,1,0,0,0|3,0,0]=4 224 B13R1.19 Cc1ccc(cc1)CN(C)CCF 269982a_100000744650_100011217306 [0,0,1,0,0,0|3,0,0]=4 225 B13R1.19 Cc1ccc(cc1)CN(C)CCF 34a_100000744650_100011217306 [0,0,1,0,0,0|3,0,0]=4 226 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000186992_200000210301 [0,0,1,0,0,0|2,0,0]=3 227 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000210814 [0,0,1,0,0,0|2,0,0]=3 228 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000744650_100000211926 [0,0,1,0,0,0|2,0,0]=3 229 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000186992_200000210301 [0,0,1,0,0,0|2,0,0]=3 230 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000210263_100000210814 [0,0,1,0,0,0|2,0,0]=3 231 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000744650_100000211926 [0,0,1,0,0,0|2,0,0]=3 232 B13R1.19 Cc1ccc(cc1)CN(C)CCO 26a_100000210263_200020625495 [0,0,1,0,0,0|2,0,0]=3 233 B13R1.19 Cc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000211033 [0,0,1,0,0,0|2,0,0]=3 234 B13R1.19 Cc1ccc(cc1)CN(C)CCO 34a_100000186992_200000210301 [0,0,1,0,0,0|2,0,0]=3 235 B13R1.19 Cc1ccc(cc1)CN(C)CCO 34a_100000744650_100000211926 [0,0,1,0,0,0|2,0,0]=3 236 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 2230a_100000186992_200025704644 [0,0,1,0,0,0|2,0,0]=3 237 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 269982a_100000186992_200025704644 [0,0,1,0,0,0|2,0,0]=3 238 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 34a_100000186992_200025704644 [0,0,1,0,0,0|2,0,0]=3 239 B13R1.19 Cc1ccc(cc1)NC(=O)CCO 22a_100000124888_100011216618 [0,0,1,0,0,0|1,0,1]=3 240 B13R1.19 Cc1ccc(cc1)NC(C)CCO 34a_100000124888_100009893172 [0,0,1,0,0,0|0,0,0]=1 241 B13R1.19 Cc1ccc(cc1)OC(C)CC#N 7a_100000210336_100009813641 [0,0,1,0,0,0|2,0,1]=4 242 B13R1.19 Cc1ccc(cc1)OC(C)CCO 34a_100000210336_100009893172 [0,0,1,0,0,0|1,0,0]=2 243 B13R1.19 Cc1ccc(cc1)OC(C)CCO 7a_100000210336_100009893172 [0,0,1,0,0,0|1,0,0]=2 244 B13R1.19 Cc1ccc(cc1)OC(C)CN[13CH3] 2230a_100000763606_200025704644 [0,0,1,0,0,0|3,0,0]=4 245 B13R1.19 Cc1ccc(cc1)OC(C)CN[13CH3] 34a_100000763606_200025704644 [0,0,1,0,0,0|3,0,0]=4 246 B13R1.19 Cc1ccc(cc1)SC(C)CC#N 62a_100000186775_100009813641 [0,0,1,0,0,0|2,0,1]=4 247 B13R1.19 Cc1ccc(cc1)SC(C)CC#N 62a_100009813641_100000186775 [0,0,1,0,0,0|2,0,1]=4 248 B13R1.19 Cc1ccc(cc1)SC(C)CCO 62a_100000186775_100009893172 [0,0,1,0,0,0|1,0,0]=2 249 B13R1.19 Cc1ccc(cc1)SC(C)CCO 62a_100009893172_100000186775 [0,0,1,0,0,0|1,0,0]=2 250 B13R1.19 Cc1ccc(cn1)CN(C)CCO 2230a_100000210263_100016987292 [0,0,1,0,0,0|3,0,0]=4 251 B13R1.19 Cc1ccc(cn1)CN(C)CCO 2230a_106623407658_100000211926 [0,0,1,0,0,0|3,0,0]=4 252 B13R1.19 Cc1ccc(cn1)CN(C)CCO 269982a_100000210263_100016987292 [0,0,1,0,0,0|3,0,0]=4 253 B13R1.19 Cc1ccc(cn1)CN(C)CCO 269982a_106623407658_100000211926 [0,0,1,0,0,0|3,0,0]=4 254 B13R1.19 Cc1ccc(cn1)CN(C)CCO 270004a_100000210263_100000743784 [0,0,1,0,0,0|3,0,0]=4 255 B13R1.19 Cc1ccc(cn1)CN(C)CCO 34a_106623407658_100000211926 [0,0,1,0,0,0|3,0,0]=4 256 B13R1.19 Cc1ccc(cn1)OC(C)CCO 34a_100000745506_100009893172 [0,0,1,0,0,0|2,0,0]=3 257 B13R1.19 Cc1ccc(cn1)OC(C)CCO 7a_100000745506_100009893172 [0,0,1,0,0,0|2,0,0]=3 258 B13R1.19 Cc1ccc(cn1)SC(C)CCO 62a_100000751577_100009893172 [0,0,1,0,0,0|2,0,0]=3 259 B13R1.19 Cc1ccc(cn1)SC(C)CCO 62a_100009893172_100000751577 [0,0,1,0,0,0|2,0,0]=3 260 B13R1.19 Cc1ccc(nc1)CN(C)CCO 2230a_100000210263_100000691093 [0,0,1,0,0,0|3,0,0]=4 261 B13R1.19 Cc1ccc(nc1)CN(C)CCO 2230a_200000717808_100000211926 [0,0,1,0,0,0|3,0,0]=4 262 B13R1.19 Cc1ccc(nc1)CN(C)CCO 269982a_100000210263_100000691093 [0,0,1,0,0,0|3,0,0]=4 263 B13R1.19 Cc1ccc(nc1)CN(C)CCO 269982a_200000717808_100000211926 [0,0,1,0,0,0|3,0,0]=4 264 B13R1.19 Cc1ccc(nc1)CN(C)CCO 270004a_100000210263_100000050478 [0,0,1,0,0,0|3,0,0]=4 265 B13R1.19 Cc1ccc(nc1)OC(C)CCO 34a_100000759353_100009893172 [0,0,1,0,0,0|2,0,0]=3 266 B13R1.19 Cc1ccc(nc1)SC(C)CCO 62a_100009893172_100000754016 [0,0,1,0,0,0|2,0,0]=3 267 B13R1.19 Cc1ccc(nc1)SC(C)CCO 62a_100011192072_100009893172 [0,0,1,0,0,0|2,0,0]=3 268 B13R1.19 Cc1ccc(nn1)N[C@H](C)CCO 27a_100000706166_100000744512 [0,0,1,0,0,0|2,0,0]=3 269 B13R1.19 Cc1ccc(nn1)SC(C)CCO 62a_100000744512_100009893172 [0,0,1,0,0,0|3,0,0]=4 270 B13R1.19 Cc1ccc(nn1)SC(C)CCO 62a_100009893172_100000744512 [0,0,1,0,0,0|3,0,0]=4 271 B13R1.19 Cc1cnc(cn1)N[C@H](C)CCO 27a_100000706166_100000074397 [0,0,1,0,0,0|2,0,0]=3 272 B13R1.19 Cc1cnc(cn1)SC(C)CCO 62a_100009893172_100011999403 [0,0,1,0,0,0|3,0,0]=4 273 B13R1.19 Cc1cnc(cn1)SC(C)CCO 62a_100011999403_100009893172 [0,0,1,0,0,0|3,0,0]=4 274 B13R1.19 Cc1cnc(nc1)N[C@H](C)CCO 27a_100000706166_100000061069 [0,0,1,0,0,0|2,0,0]=3 275 B13R1.19 Cc1cnc(nc1)SC(C)CCO 62a_100000061069_100009893172 [0,0,1,0,0,0|3,0,0]=4 276 B13R1.19 Cc1cnc(nc1)SC(C)CCO 62a_100009893172_100000061069 [0,0,1,0,0,0|3,0,0]=4 277 B13R1.19 Cc1ncc(cn1)OC(C)CCO 34a_100000062939_100009893172 [0,0,1,0,0,0|3,0,0]=4 278 B13R1.19 Cc1ncc(cn1)OC(C)CCO 7a_100000062939_100009893172 [0,0,1,0,0,0|3,0,0]=4 279 B13R1.19 Cc1ncc(cn1)SC(C)CCO 62a_100000686985_100009893172 [0,0,1,0,0,0|3,0,0]=4 280 B13R1.19 Cc1ncc(cn1)SC(C)CCO 62a_100009893172_100000686985 [0,0,1,0,0,0|3,0,0]=4 281 B13R1.19 O=C(CCO)Nc1ccc(cc1)Br 22a_100000210018_100011216618 [0,0,1,0,0,0|2,0,1]=4 282 B13R1.19 O=C(CCO)Nc1ccc(cc1)Cl 22a_100000210052_100011216618 [0,0,1,0,0,0|2,0,1]=4 283 B13R1.19 O=C(CCO)Nc1ccc(cc1)F 22a_100000185862_100011216618 [0,0,1,0,0,0|2,0,1]=4 284 B13R1.19 O=C(CCO)Nc1ccc(cc1)I 22a_100000185761_100011216618 [0,0,1,0,0,0|2,0,1]=4 285 B13R1.19 O=C(CCO)Nc1ccc(cc1)O 22a_100000185829_100011216618 [0,0,1,0,0,0|2,0,1]=4 286 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 2230a_100000186819_200025704644 [0,0,1,0,0,0|3,0,0]=4 287 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 269982a_100000186819_200025704644 [0,0,1,0,0,0|3,0,0]=4 288 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 34a_100000186819_200025704644 [0,0,1,0,0,0|3,0,0]=4 289 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 2230a_100015183715_200025704644 [0,0,1,0,0,0|3,0,0]=4 290 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 269982a_100015183715_200025704644 [0,0,1,0,0,0|3,0,0]=4 291 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 34a_100015183715_200025704644 [0,0,1,0,0,0|3,0,0]=4 292 B13R1.51 C#Cc1cc(ccc1NC(C)C)C 34a_200012001881_100000210206 [0,0,1,0,0,0|1,0,1]=3 293 B13R1.51 CC(=Cc1ccc(cc1CO)Br)C 271570a_100102525489_100011356890 [0,0,1,0,0,0|2,0,1]=4 294 B13R1.51 CC(=Cc1ccc(cc1CO)C)C 271570a_100102525489_100012361352 [0,0,1,0,0,0|1,0,1]=3 295 B13R1.51 CC(=Cc1ccc(cc1CO)F)C 271570a_100102525489_100011217561 [0,0,1,0,0,0|2,0,1]=4 296 B13R1.51 CC(=Cc1ccc(cc1CO)N)C 271570a_100102525489_100012347228 [0,0,1,0,0,0|2,0,1]=4 297 B13R1.51 CC(=Cc1ccc(cc1CO)O)C 271570a_100102525489_100012351483 [0,0,1,0,0,0|2,0,1]=4 298 B13R1.51 CC(=Cc1ccc(nc1CO)C)C 271570a_100102525489_100010074375 [0,0,1,0,0,0|2,0,1]=4 299 B13R1.51 CC(=Cc1cnc(cc1CO)C)C 271570a_100102525489_100015579599 [0,0,1,0,0,0|2,0,1]=4 300 B13R1.51 CC(=Cc1ncc(cc1CO)C)C 271570a_100102525489_100000118064 [0,0,1,0,0,0|2,0,1]=4 301 B13R1.51 CC(=O)Nc1ccc(cc1CO)Br 22a_100012353972_100000070787 [0,0,1,0,0,0|2,0,1]=4 302 B13R1.51 CC(=O)Nc1ccc(cc1CO)C 22a_100011215565_100000070787 [0,0,1,0,0,0|1,0,1]=3 303 B13R1.51 CC(=O)Nc1ccc(cc1CO)C 527a_100011215565_100103153847 [0,0,1,0,0,0|1,0,1]=3 304 B13R1.51 CC(=O)Nc1ccc(cc1CO)Cl 22a_100011214999_100000070787 [0,0,1,0,0,0|2,0,1]=4 305 B13R1.51 CC(=O)Nc1ccc(cc1CO)F 22a_100011296978_100000070787 [0,0,1,0,0,0|2,0,1]=4 306 B13R1.51 CC(=O)Nc1ccc(cc1CO)I 22a_114929179932_100000070787 [0,0,1,0,0,0|2,0,1]=4 307 B13R1.51 CC(C)Nc1ccc(cc1C#N)Br 27a_100138425928_100011219714 [0,0,1,0,0,0|2,0,1]=4 308 B13R1.51 CC(C)Nc1ccc(cc1C#N)Br 7a_100000688460_100000210206 [0,0,1,0,0,0|2,0,1]=4 309 B13R1.51 CC(C)Nc1ccc(cc1C#N)Cl 7a_100011219925_100000210206 [0,0,1,0,0,0|2,0,1]=4 310 B13R1.51 CC(C)Nc1ccc(cc1C#N)F 34a_100000685569_100000210206 [0,0,1,0,0,0|2,0,1]=4 311 B13R1.51 CC(C)Nc1ccc(cc1C#N)F 7a_100000685569_100000210206 [0,0,1,0,0,0|2,0,1]=4 312 B13R1.51 CC(C)Nc1ccc(cc1C#N)I 7a_100000049818_100000210206 [0,0,1,0,0,0|2,0,1]=4 313 B13R1.51 CC(C)Nc1ccc(cc1CO)Br 34a_100012353972_100000210206 [0,0,1,0,0,0|1,0,0]=2 314 B13R1.51 CC(C)Nc1ccc(cc1CO)Cl 34a_100011214999_100000210206 [0,0,1,0,0,0|1,0,0]=2 315 B13R1.51 CC(C)Nc1ccc(cc1CO)F 34a_100011296978_100000210206 [0,0,1,0,0,0|1,0,0]=2 316 B13R1.51 CC(C)Oc1ccc(cc1CBr)F 34a_100010161318_100000210206 [0,0,1,0,0,0|3,0,0]=4 317 B13R1.51 CC(C)Oc1ccc(cc1CBr)F 7a_100010161318_100000210206 [0,0,1,0,0,0|3,0,0]=4 318 B13R1.51 CC(C)Oc1ccc(cc1CN)Br 34a_100000730032_100000210206 [0,0,1,0,0,0|3,0,0]=4 319 B13R1.51 CC(C)Oc1ccc(cc1CN)Cl 34a_100000238540_100000210206 [0,0,1,0,0,0|3,0,0]=4 320 B13R1.51 CC(C)Oc1ccc(cc1CO)Br 34a_100000184703_100000210206 [0,0,1,0,0,0|2,0,0]=3 321 B13R1.51 CC(C)Oc1ccc(cc1CO)Br 7a_100000184703_100000210206 [0,0,1,0,0,0|2,0,0]=3 322 B13R1.51 CC(C)Oc1ccc(cc1CO)Cl 34a_100011218961_100000210206 [0,0,1,0,0,0|2,0,0]=3 323 B13R1.51 CC(C)Oc1ccc(cc1CO)Cl 7a_100011218961_100000210206 [0,0,1,0,0,0|2,0,0]=3 324 B13R1.51 CC(C)Oc1ccc(cc1CO)F 34a_100011291448_100000210206 [0,0,1,0,0,0|2,0,0]=3 325 B13R1.51 CC(C)Oc1ccc(cc1CO)F 7a_100011291448_100000210206 [0,0,1,0,0,0|2,0,0]=3 326 B13R1.51 CC(C)Oc1ccc(cc1CO)I 34a_100000049520_100000210206 [0,0,1,0,0,0|2,0,0]=3 327 B13R1.51 CC(C)Oc1ccc(cc1CO)I 7a_100000049520_100000210206 [0,0,1,0,0,0|2,0,0]=3 328 B13R1.51 CC(C)Sc1ccc(cc1CN)F 62a_100000210206_100000742738 [0,0,1,0,0,0|3,0,0]=4 329 B13R1.51 CC(C)Sc1ccc(cc1CN)F 62a_100000742738_100000210206 [0,0,1,0,0,0|3,0,0]=4 330 B13R1.51 CC(C)Sc1ccc(cc1CO)Br 62a_100000210206_100011356890 [0,0,1,0,0,0|2,0,0]=3 331 B13R1.51 CC(C)Sc1ccc(cc1CO)Br 62a_100011356890_100000210206 [0,0,1,0,0,0|2,0,0]=3 332 B13R1.51 CC(C)Sc1ccc(cc1CO)F 62a_100000210206_100011217561 [0,0,1,0,0,0|2,0,0]=3 333 B13R1.51 CC(C)Sc1ccc(cc1CO)F 62a_100011217561_100000210206 [0,0,1,0,0,0|2,0,0]=3 334 B13R1.51 CC(C)Sc1ccc(cc1CO)N 62a_100000210206_100012347228 [0,0,1,0,0,0|2,0,0]=3 335 B13R1.51 CC(C)Sc1ccc(cc1CO)N 62a_100012347228_100000210206 [0,0,1,0,0,0|2,0,0]=3 336 B13R1.51 CC(C)Sc1ccc(cc1CO)O 62a_100000210206_100012351483 [0,0,1,0,0,0|2,0,0]=3 337 B13R1.51 CC(C)Sc1ccc(cc1CO)O 62a_100012351483_100000210206 [0,0,1,0,0,0|2,0,0]=3 338 B13R1.51 CC(C)Sc1ccc(nc1CO)F 62a_100000210206_100000701195 [0,0,1,0,0,0|3,0,0]=4 339 B13R1.51 CC(C)Sc1ccc(nc1CO)F 62a_100000701195_100000210206 [0,0,1,0,0,0|3,0,0]=4 340 B13R1.51 CC(C)Sc1ncc(cc1CO)F 62a_100000079972_100000210206 [0,0,1,0,0,0|3,0,0]=4 341 B13R1.51 CC(C)Sc1ncc(cc1CO)F 62a_100000210206_100000079972 [0,0,1,0,0,0|3,0,0]=4 342 B13R1.51 CCc1cc(ccc1NC(C)C)Br 2230a_100000686106_100000210206 [0,0,1,0,0,0|2,0,0]=3 343 B13R1.51 CCc1cc(ccc1NC(C)C)Br 34a_100000686106_100000210206 [0,0,1,0,0,0|2,0,0]=3 344 B13R1.51 CCc1cc(ccc1NC(C)C)Br 7a_100000686106_100000210206 [0,0,1,0,0,0|2,0,0]=3 345 B13R1.51 CCc1cc(ccc1NC(C)C)Cl 2230a_100012017146_100000210206 [0,0,1,0,0,0|2,0,0]=3 346 B13R1.51 CCc1cc(ccc1NC(C)C)Cl 34a_100012017146_100000210206 [0,0,1,0,0,0|2,0,0]=3 347 B13R1.51 CCc1cc(ccc1NC(C)C)Cl 7a_100012017146_100000210206 [0,0,1,0,0,0|2,0,0]=3 348 B13R1.51 CCc1cc(ccc1NC(C)C)I 2230a_100000014069_100000210206 [0,0,1,0,0,0|2,0,0]=3 349 B13R1.51 CCc1cc(ccc1NC(C)C)I 34a_100000014069_100000210206 [0,0,1,0,0,0|2,0,0]=3 350 B13R1.51 CCc1cc(ccc1NC(C)C)I 7a_100000014069_100000210206 [0,0,1,0,0,0|2,0,0]=3 351 B13R1.51 CCc1cc(ccc1OC(C)C)Br 34a_100012338938_100000210206 [0,0,1,0,0,0|3,0,0]=4 352 B13R1.51 CCc1cc(ccc1OC(C)C)Br 7a_100012338938_100000210206 [0,0,1,0,0,0|3,0,0]=4 353 B13R1.51 CCc1cc(ccc1OC(C)C)C 34a_100009844793_100000210206 [0,0,1,0,0,0|2,0,0]=3 354 B13R1.51 CCc1cc(ccc1OC(C)C)C 7a_100009844793_100000210206 [0,0,1,0,0,0|2,0,0]=3 355 B13R1.51 CCc1cc(ccc1OC(C)C)F 34a_200000035566_100000210206 [0,0,1,0,0,0|3,0,0]=4 356 B13R1.51 CCc1cc(ccc1OC(C)C)F 7a_200000035566_100000210206 [0,0,1,0,0,0|3,0,0]=4 357 B13R1.51 CCc1cc(ccc1SC(C)C)Br 62a_100000210206_100011216195 [0,0,1,0,0,0|3,0,0]=4 358 B13R1.51 CCc1cc(ccc1SC(C)C)Br 62a_100011216195_100000210206 [0,0,1,0,0,0|3,0,0]=4 359 B13R1.51 CCc1cc(ccc1SC(C)C)N 62a_100000210206_100010109747 [0,0,1,0,0,0|3,0,0]=4 360 B13R1.51 CCc1cc(ccc1SC(C)C)N 62a_100010109747_100000210206 [0,0,1,0,0,0|3,0,0]=4 361 B13R1.51 CCc1nc(ccc1OC(C)C)C 34a_100000718140_100000210206 [0,0,1,0,0,0|3,0,0]=4 362 B13R1.51 CCc1nc(ccc1OC(C)C)C 7a_100000718140_100000210206 [0,0,1,0,0,0|3,0,0]=4 363 B13R1.51 CNc1cc(ccc1OC(C)C)C 2230a_200103155816_200000210301 [0,0,1,0,0,0|3,0,0]=4 364 B13R1.51 CNc1cc(ccc1OC(C)C)C 34a_200103155816_200000210301 [0,0,1,0,0,0|3,0,0]=4 365 B13R1.51 CNc1cc(ccc1OC(C)C)C 7a_200103155816_200000210301 [0,0,1,0,0,0|3,0,0]=4 366 B13R1.51 COc1cc(ccc1NC(C)C)Br 34a_100011279103_100000210206 [0,0,1,0,0,0|3,0,0]=4 367 B13R1.51 COc1cc(ccc1NC(C)C)C 2230a_100000746441_100000210206 [0,0,1,0,0,0|2,0,0]=3 368 B13R1.51 COc1cc(ccc1NC(C)C)C 34a_100000746441_100000210206 [0,0,1,0,0,0|2,0,0]=3 369 B13R1.51 COc1cc(ccc1NC(C)C)Cl 34a_100000707585_100000210206 [0,0,1,0,0,0|3,0,0]=4 370 B13R1.51 COc1cc(ccc1NC(C)C)F 34a_100000737216_100000210206 [0,0,1,0,0,0|3,0,0]=4 371 B13R1.51 COc1cc(ccc1NC(C)C)I 34a_100015196925_100000210206 [0,0,1,0,0,0|3,0,0]=4 372 B13R1.51 COc1cc(ccc1NC(C)C)O 34a_100015326901_100000210206 [0,0,1,0,0,0|3,0,0]=4 373 B13R1.51 COc1cc(ccc1OC(C)C)C 34a_100000186466_100000210206 [0,0,1,0,0,0|3,0,0]=4 374 B13R1.51 COc1cc(ccc1SC(C)C)C 62a_100000210206_100010200004 [0,0,1,0,0,0|3,0,0]=4 375 B13R1.51 COc1cc(ccc1SC(C)C)C 62a_100010200004_100000210206 [0,0,1,0,0,0|3,0,0]=4 376 B13R1.51 CSc1cc(ccc1SC(C)C)C 62a_100000210206_200010709736 [0,0,1,0,0,0|3,0,0]=4 377 B13R1.51 CSc1cc(ccc1SC(C)C)C 62a_200010709736_100000210206 [0,0,1,0,0,0|3,0,0]=4 378 B13R1.51 CSc1cc(cnc1NC(C)C)C 27a_100138425928_100010884634 [0,0,1,0,0,0|3,0,0]=4 379 B13R1.51 Cc1cc(c(cn1)SC(C)C)CO 62a_100000210206_100015579599 [0,0,1,0,0,0|2,0,0]=3 380 B13R1.51 Cc1cc(c(cn1)SC(C)C)CO 62a_100015579599_100000210206 [0,0,1,0,0,0|2,0,0]=3 381 B13R1.51 Cc1ccc(c(c1)C#N)NC(C)C 7a_100011934023_100000210206 [0,0,1,0,0,0|1,0,1]=3 382 B13R1.51 Cc1ccc(c(c1)C#N)OC(C)C 34a_200012180384_100000210206 [0,0,1,0,0,0|2,0,1]=4 383 B13R1.51 Cc1ccc(c(c1)C#N)OC(C)C 7a_200012180384_100000210206 [0,0,1,0,0,0|2,0,1]=4 384 B13R1.51 Cc1ccc(c(c1)C#N)SC(C)C 62a_100000210206_100011935190 [0,0,1,0,0,0|2,0,1]=4 385 B13R1.51 Cc1ccc(c(c1)C=O)SC(C)C 62a_100000210206_100011551863 [0,0,1,0,0,0|1,0,2]=4 386 B13R1.51 Cc1ccc(c(c1)C=O)SC(C)C 62a_100011551863_100000210206 [0,0,1,0,0,0|1,0,2]=4 387 B13R1.51 Cc1ccc(c(c1)CO)NC(C)C 34a_100011215565_100000210206 [0,0,1,0,0,0|0,0,0]=1 388 B13R1.51 Cc1ccc(c(c1)CO)OC(C)C 34a_200011846009_100000210206 [0,0,1,0,0,0|1,0,0]=2 389 B13R1.51 Cc1ccc(c(c1)CO)OC(C)C 7a_200011846009_100000210206 [0,0,1,0,0,0|1,0,0]=2 390 B13R1.51 Cc1ccc(c(c1)CO)SC(C)C 62a_100000210206_100012361352 [0,0,1,0,0,0|1,0,0]=2 391 B13R1.51 Cc1ccc(c(c1)CO)SC(C)C 62a_100012361352_100000210206 [0,0,1,0,0,0|1,0,0]=2 392 B13R1.51 Cc1ccc(c(c1)N[13CH3])OC(C)C 2230a_200103155816_200025704644 [0,0,1,0,0,0|3,0,0]=4 393 B13R1.51 Cc1ccc(c(c1)N[13CH3])OC(C)C 34a_200103155816_200025704644 [0,0,1,0,0,0|3,0,0]=4 394 B13R1.51 Cc1ccc(c(c1)N[13CH3])OC(C)C 7a_200103155816_200025704644 [0,0,1,0,0,0|3,0,0]=4 395 B13R1.51 Cc1ccc(c(n1)CCl)OC(C)C 34a_100020630696_100000210206 [0,0,1,0,0,0|3,0,0]=4 396 B13R1.51 Cc1ccc(c(n1)CCl)OC(C)C 7a_100020630696_100000210206 [0,0,1,0,0,0|3,0,0]=4 397 B13R1.51 Cc1ccc(c(n1)CO)OC(C)C 34a_100000751967_100000210206 [0,0,1,0,0,0|2,0,0]=3 398 B13R1.51 Cc1ccc(c(n1)CO)SC(C)C 62a_100000210206_100010074375 [0,0,1,0,0,0|2,0,0]=3 399 B13R1.51 Cc1ccc(c(n1)CO)SC(C)C 62a_100010074375_100000210206 [0,0,1,0,0,0|2,0,0]=3 400 B13R1.51 Cc1cnc(c(c1)C#N)NC(C)C 27a_100138425928_100012662280 [0,0,1,0,0,0|2,0,1]=4 401 B13R1.51 Cc1cnc(c(c1)CO)SC(C)C 62a_100000118064_100000210206 [0,0,1,0,0,0|2,0,0]=3 402 B13R1.51 Cc1cnc(c(c1)CO)SC(C)C 62a_100000210206_100000118064 [0,0,1,0,0,0|2,0,0]=3 403 B13R1.141 C=C(C)c1cc(ccc1NCC)F 34a_100009961556_100000210202 [0,0,1,0,0,0|2,0,1]=4 404 B13R1.141 C=C(C)c1cc(ccc1OCC)C 271570a_100000694244_200000230997 [0,0,1,0,0,0|2,0,1]=4 405 B13R1.141 CC(C)c1cc(ccc1NCF)Br 34a_100000694223_100015361967 [0,0,1,0,0,0|3,0,0]=4 406 B13R1.141 CC(C)c1cc(ccc1NCF)Br 7a_100000694223_100015361967 [0,0,1,0,0,0|3,0,0]=4 407 B13R1.141 CC(C)c1cc(ccc1NCF)F 34a_100011941472_100015361967 [0,0,1,0,0,0|3,0,0]=4 408 B13R1.141 CC(C)c1cc(ccc1NCF)F 7a_100011941472_100015361967 [0,0,1,0,0,0|3,0,0]=4 409 B13R1.141 CC(O)c1cc(ccc1OCF)F 34a_200011305312_100015361967 [0,0,1,0,0,0|3,0,0]=4 410 B13R1.141 CC(O)c1cc(ccc1OCF)F 7a_200011305312_100015361967 [0,0,1,0,0,0|3,0,0]=4 411 B13R1.141 CC=Cc1ccc(cc1[C@H](C)O)F 271570a_100016259895_100134768474 [0,0,1,0,0,0|2,0,1]=4 412 B13R1.141 CCNc1ccc(cc1C(=O)N)C 34a_100011692829_100000210202 [0,0,1,0,0,0|1,0,2]=4 413 B13R1.141 CCNc1ccc(cc1C(C)C)Br 2230a_100000694223_100000210202 [0,0,1,0,0,0|2,0,0]=3 414 B13R1.141 CCNc1ccc(cc1C(C)C)Br 34a_100000694223_100000210202 [0,0,1,0,0,0|2,0,0]=3 415 B13R1.141 CCNc1ccc(cc1C(C)C)Br 7a_100000694223_100000210202 [0,0,1,0,0,0|2,0,0]=3 416 B13R1.141 CCNc1ccc(cc1C(C)C)F 2230a_100011941472_100000210202 [0,0,1,0,0,0|2,0,0]=3 417 B13R1.141 CCNc1ccc(cc1C(C)C)F 34a_100011941472_100000210202 [0,0,1,0,0,0|2,0,0]=3 418 B13R1.141 CCNc1ccc(cc1C(C)C)F 7a_100011941472_100000210202 [0,0,1,0,0,0|2,0,0]=3 419 B13R1.141 CCOc1ccc(cc1C(=O)C)C 34a_100000195442_100000210202 [0,0,1,0,0,0|1,0,2]=4 420 B13R1.141 CCOc1ccc(cc1C(=O)C)C 7a_100000195442_100000210202 [0,0,1,0,0,0|1,0,2]=4 421 B13R1.141 CCOc1ccc(cc1C(C)C)Br 34a_100000691460_100000210202 [0,0,1,0,0,0|3,0,0]=4 422 B13R1.141 CCOc1ccc(cc1C(C)C)Br 7a_100000691460_100000210202 [0,0,1,0,0,0|3,0,0]=4 423 B13R1.141 CCOc1ccc(cc1C(C)O)F 34a_200011305312_100000210202 [0,0,1,0,0,0|2,0,0]=3 424 B13R1.141 CCOc1ccc(cc1C(C)O)F 7a_200011305312_100000210202 [0,0,1,0,0,0|2,0,0]=3 425 B13R1.141 CCOc1ccc(cc1[C@@H](C)N)Cl 34a_100011853016_100000210202 [0,0,1,0,0,0|3,0,0]=4 426 B13R1.141 CCOc1ccc(cc1[C@@H](C)N)Cl 7a_100011853016_100000210202 [0,0,1,0,0,0|3,0,0]=4 427 B13R1.141 CCOc1ccc(cc1[C@H](C)N)F 34a_100160469477_100000210202 [0,0,1,0,0,0|3,0,0]=4 428 B13R1.141 CCOc1ccc(cc1[C@H](C)N)F 7a_100160469477_100000210202 [0,0,1,0,0,0|3,0,0]=4 429 B13R1.141 CCSc1ccc(cc1B(O)O)C 62a_100000210202_200010883979 [0,0,1,0,0,0|3,0,0]=4 430 B13R1.141 CCSc1ccc(cc1B(O)O)C 62a_200010883979_100000210202 [0,0,1,0,0,0|3,0,0]=4 431 B13R1.141 CCSc1ccc(cc1C(=O)C)C 62a_100000210202_100012361225 [0,0,1,0,0,0|1,0,2]=4 432 B13R1.141 CCSc1ccc(cc1C(=O)C)C 62a_100012361225_100000210202 [0,0,1,0,0,0|1,0,2]=4 433 B13R1.141 CCSc1ccc(cc1C(C)C)Br 62a_100000210202_100010244561 [0,0,1,0,0,0|3,0,0]=4 434 B13R1.141 CCSc1ccc(cc1C(C)C)Br 62a_100010244561_100000210202 [0,0,1,0,0,0|3,0,0]=4 435 B13R1.141 CCSc1ccc(cc1C(C)N)F 62a_100000210202_100012343209 [0,0,1,0,0,0|3,0,0]=4 436 B13R1.141 CCSc1ccc(cc1C(C)N)F 62a_100012343209_100000210202 [0,0,1,0,0,0|3,0,0]=4 437 B13R1.141 CCSc1ccc(cc1[C@H](C)O)F 62a_100000210202_100134768474 [0,0,1,0,0,0|2,0,0]=3 438 B13R1.141 CCSc1ccc(cc1[C@H](C)O)F 62a_100134768474_100000210202 [0,0,1,0,0,0|2,0,0]=3 439 B13R1.141 C[C@H](O)c1cc(ccc1SCF)F 62a_100015361967_100134768474 [0,0,1,0,0,0|3,0,0]=4 440 B13R1.141 C[C@H](O)c1cc(ccc1SCF)F 62a_100134768474_100015361967 [0,0,1,0,0,0|3,0,0]=4 441 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [0,0,1,0,0,0|2,0,1]=4 442 B13R1.147 CC(C)C[C@H](N)c1ccc[n+](c1)C 271570a_100015190218_100009996589 [0,0,1,0,0,0|3,0,0]=4 443 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Br 271570a_100015190218_100000691529 [0,0,1,0,0,0|3,0,0]=4 444 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Cl 271570a_100015190218_100000699651 [0,0,1,0,0,0|3,0,0]=4 445 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)F 271570a_100015190218_100000685547 [0,0,1,0,0,0|3,0,0]=4 446 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)N 271570a_100015190218_100000210019 [0,0,1,0,0,0|3,0,0]=4 447 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [0,0,1,0,0,0|3,0,0]=4 448 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)[S] 271570a_100015190218_114929384022 [0,0,1,0,0,0|3,0,0]=4 449 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 2230a_200000733937_200000210301 [0,0,1,0,0,0|3,0,0]=4 450 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 269982a_200000733937_200000210301 [0,0,1,0,0,0|3,0,0]=4 451 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_200000210301 [0,0,1,0,0,0|3,0,0]=4 452 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_200000210301 [0,0,1,0,0,0|3,0,0]=4 453 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 2230a_200000733937_200025704644 [0,0,1,0,0,0|3,0,0]=4 454 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 269982a_200000733937_200025704644 [0,0,1,0,0,0|3,0,0]=4 455 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 2230a_100009815823_200025704644 [0,0,1,0,0,0|3,0,0]=4 456 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 269982a_100009815823_200025704644 [0,0,1,0,0,0|3,0,0]=4 457 B13R1.147 Cc1cc(ccn1)[C@@H](N)CC(C)C 271570a_100015190218_100000758586 [0,0,1,0,0,0|3,0,0]=4 458 B13R1.147 Cc1cccc(c1)C(=O)CC(C)C 1458a_100000189346_100000210624 [0,0,1,0,0,0|1,0,2]=4 459 B13R1.147 Cc1cccc(c1)C(=O)CC(C)O 1458a_100000189346_100011218427 [0,0,1,0,0,0|1,0,2]=4 460 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 34a_100000757818_100000210206 [0,0,1,0,0,0|3,0,0]=4 461 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 7a_100000757818_100000210206 [0,0,1,0,0,0|3,0,0]=4 462 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 2230a_100000219674_100000210760 [0,0,1,0,0,0|3,0,0]=4 463 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 269982a_100000219674_100000210624 [0,0,1,0,0,0|3,0,0]=4 464 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 34a_100000219674_100000210624 [0,0,1,0,0,0|3,0,0]=4 465 B13R1.147 Cc1cccc(c1)N(C)CC(C)O 2230a_100000219674_100011218427 [0,0,1,0,0,0|3,0,0]=4 466 B13R1.147 Cc1cccc(c1)N(C)CC(C)O 269982a_100000219674_100011218427 [0,0,1,0,0,0|3,0,0]=4 467 B13R1.147 Cc1cccc(c1)N(C)CC(C)O 34a_100000219674_100011218427 [0,0,1,0,0,0|3,0,0]=4 468 B13R1.147 Cc1cccc(c1)N(C)C[C@@H](C)O 2230a_100000219674_100009817552 [0,0,1,0,0,0|3,0,0]=4 469 B13R1.147 Cc1cccc(c1)N(C)C[C@@H](C)O 269982a_100000219674_100009817552 [0,0,1,0,0,0|3,0,0]=4 470 B13R1.147 Cc1cccc(c1)N(C)C[C@@H](C)O 34a_100000219674_100009817552 [0,0,1,0,0,0|3,0,0]=4 471 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 2230a_100000698126_100000210206 [0,0,1,0,0,0|3,0,0]=4 472 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 34a_100000698126_100000210206 [0,0,1,0,0,0|3,0,0]=4 473 B13R1.147 Cc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100011215228 [0,0,1,0,0,0|2,0,0]=3 474 B13R1.147 Cc1cccc(n1)[C@@H](N)CC(C)C 271570a_100015190218_100000742759 [0,0,1,0,0,0|3,0,0]=4 475 B13R1.147 Cc1ccnc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000750283 [0,0,1,0,0,0|3,0,0]=4 476 B13R1.147 Cc1cncc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000760492 [0,0,1,0,0,0|3,0,0]=4 477 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [0,0,1,0,0,0|2,0,1]=4 478 B13R1.446 CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210303 [0,0,1,0,0,0|1,0,2]=4 479 B13R1.446 CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210303 [0,0,1,0,0,0|1,0,2]=4 480 B13R1.446 CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210303 [0,0,1,0,0,0|1,0,2]=4 481 B13R1.446 CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210303 [0,0,1,0,0,0|1,0,2]=4 482 B13R1.446 CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210303 [0,0,1,0,0,0|1,0,2]=4 483 B13R1.446 CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210303 [0,0,1,0,0,0|1,0,2]=4 484 B13R1.446 CCNC(C)c1cc(ccc1Br)C 269862a_100015525214_100012361225 [0,0,1,0,0,0|3,0,0]=4 485 B13R1.446 CCNC(C)c1cc(ccc1C)C 269862a_100015525214_100000211711 [0,0,1,0,0,0|3,0,0]=4 486 B13R1.446 CCNC(C)c1cc(ccc1F)C 269862a_100015525214_100000760338 [0,0,1,0,0,0|3,0,0]=4 487 B13R1.446 CCNC(C)c1cc(ccc1O)C 269862a_100015525214_100000195442 [0,0,1,0,0,0|3,0,0]=4 488 B13R1.446 CCN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_100000210202 [0,0,1,0,0,0|3,0,0]=4 489 B13R1.446 CCN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_100000210202 [0,0,1,0,0,0|3,0,0]=4 490 B13R1.446 CCOC(C)c1cc(ccc1C)C 34a_200000246511_100000210202 [0,0,1,0,0,0|3,0,0]=4 491 B13R1.446 CCOC(C)c1cc(ccc1C)C 7a_200000246511_100000210202 [0,0,1,0,0,0|3,0,0]=4 492 B13R2.5187 Cc1ccc2c(c1)c(nn2C)O 271570a_203496583355_100000123007 [0,0,0,0,1,0|2,0,1]=4 493 B12R1.1 C#CCCNc1ccc(cc1)C 34a_100000124888_100000688953 [1,0,1,0,0,0|1,0,1]=4 494 B12R1.1 C=CCCNc1ccc(cc1)C 34a_100000124888_100000754431 [1,0,1,0,0,0|1,0,1]=4 495 B12R1.1 CCCCNc1ccc(cc1)Br 2230a_100000210018_100000210211 [1,0,1,0,0,0|2,0,0]=4 496 B12R1.1 CCCCNc1ccc(cc1)Br 34a_100000210018_100000210210 [1,0,1,0,0,0|2,0,0]=4 497 B12R1.1 CCCCNc1ccc(cc1)C 34a_100000124888_100000210210 [1,0,1,0,0,0|1,0,0]=3 498 B12R1.1 CCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210211 [1,0,1,0,0,0|2,0,0]=4 499 B12R1.1 CCCCNc1ccc(cc1)Cl 34a_100000210052_100000210210 [1,0,1,0,0,0|2,0,0]=4 500 B12R1.1 CCCCNc1ccc(cc1)F 34a_100000185862_100000210210 [1,0,1,0,0,0|2,0,0]=4 501 B12R1.1 CCCCNc1ccc(cc1)I 34a_100000185761_100000210210 [1,0,1,0,0,0|2,0,0]=4 502 B12R1.1 CCCCNc1ccc(cc1)O 34a_100000185829_100000210210 [1,0,1,0,0,0|2,0,0]=4 503 B12R1.1 CCCCOc1ccc(cc1)C 34a_100000210336_100000210210 [1,0,1,0,0,0|2,0,0]=4 504 B12R1.1 CCCCOc1ccc(cc1)C 7a_100000210336_100000210211 [1,0,1,0,0,0|2,0,0]=4 505 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000186775_100000210210 [1,0,1,0,0,0|2,0,0]=4 506 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000210211_100000186775 [1,0,1,0,0,0|2,0,0]=4 507 B12R1.1 COCCNc1ccc(cc1)C 34a_100000124888_100011201679 [1,0,1,0,0,0|2,0,0]=4 508 B12R1.1 CSCCNc1ccc(cc1)C 34a_100000124888_100000212216 [1,0,1,0,0,0|2,0,0]=4 509 B12R1.1 Cc1ccc(cc1)CNCCO 207a_100000210304_100000211033 [1,0,1,0,0,0|2,0,0]=4 510 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100000174908_100000211926 [1,0,1,0,0,0|2,0,0]=4 511 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100016997473_100000210814 [1,0,1,0,0,0|2,0,0]=4 512 B12R1.1 Cc1ccc(cc1)CNCCO 270004a_100000210304_100000211033 [1,0,1,0,0,0|2,0,0]=4 513 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100000174908_100000211926 [1,0,1,0,0,0|2,0,0]=4 514 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100016990907_100000210814 [1,0,1,0,0,0|2,0,0]=4 515 B12R1.1 Cc1ccc(cc1)COCCO 34a_100011215236_100000211926 [1,0,1,0,0,0|2,0,0]=4 516 B12R1.1 Cc1ccc(cc1)COCCO 7a_100011215236_100000211926 [1,0,1,0,0,0|2,0,0]=4 517 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000210814_100000211926 [1,0,1,0,0,0|2,0,0]=4 518 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000211926_100000210814 [1,0,1,0,0,0|2,0,0]=4 519 B12R1.1 Cc1ccc(cc1)NCCCF 34a_100000124888_100011934791 [1,0,1,0,0,0|1,0,0]=3 520 B12R1.1 Cc1ccc(cc1)NCCCO 34a_100000124888_100000230001 [1,0,1,0,0,0|0,0,0]=2 521 B12R1.1 Cc1ccc(cc1)OCCCF 34a_100000210336_100011934791 [1,0,1,0,0,0|2,0,0]=4 522 B12R1.1 Cc1ccc(cc1)OCCCF 7a_100000210336_100011934791 [1,0,1,0,0,0|2,0,0]=4 523 B12R1.1 Cc1ccc(cc1)OCCCO 34a_100000210336_100000230001 [1,0,1,0,0,0|1,0,0]=3 524 B12R1.1 Cc1ccc(cc1)OCCCO 7a_100000210336_100011215043 [1,0,1,0,0,0|1,0,0]=3 525 B12R1.1 Cc1ccc(cc1)SCCCF 62a_100000186775_100011934791 [1,0,1,0,0,0|2,0,0]=4 526 B12R1.1 Cc1ccc(cc1)SCCCF 62a_100011934791_100000186775 [1,0,1,0,0,0|2,0,0]=4 527 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100000186775_100011215043 [1,0,1,0,0,0|1,0,0]=3 528 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100011215043_100000186775 [1,0,1,0,0,0|1,0,0]=3 529 B12R1.1 Cc1ccc(cn1)OCCCO 34a_100000745506_100000230001 [1,0,1,0,0,0|2,0,0]=4 530 B12R1.1 Cc1ccc(cn1)OCCCO 7a_100000745506_100011215043 [1,0,1,0,0,0|2,0,0]=4 531 B12R1.1 Cc1ccc(cn1)SCCCO 62a_100000751577_100011215043 [1,0,1,0,0,0|2,0,0]=4 532 B12R1.1 Cc1ccc(cn1)SCCCO 62a_100011215043_100000751577 [1,0,1,0,0,0|2,0,0]=4 533 B12R1.1 Cc1ccc(nc1)OCCCO 34a_100000759353_100000230001 [1,0,1,0,0,0|2,0,0]=4 534 B12R1.1 Cc1ccc(nc1)SCCCO 62a_100011192072_100011215043 [1,0,1,0,0,0|2,0,0]=4 535 B12R1.1 Cc1ccc(nc1)SCCCO 62a_100011215043_100000754016 [1,0,1,0,0,0|2,0,0]=4 536 B12R1.1 Cc1ccc(nn1)NCCCO 27a_100000182051_100000744512 [1,0,1,0,0,0|2,0,0]=4 537 B12R1.1 Cc1cnc(cn1)NCCCO 27a_100000182051_100000074397 [1,0,1,0,0,0|2,0,0]=4 538 B12R1.1 Cc1cnc(nc1)NCCCO 27a_100000182051_100000061069 [1,0,1,0,0,0|2,0,0]=4 539 B12R1.1 FCCCNc1ccc(cc1)Br 2230a_100000210018_100011934791 [1,0,1,0,0,0|2,0,0]=4 540 B12R1.1 FCCCNc1ccc(cc1)Br 34a_100000210018_100011934791 [1,0,1,0,0,0|2,0,0]=4 541 B12R1.1 FCCCNc1ccc(cc1)Cl 2230a_100000210052_100011934791 [1,0,1,0,0,0|2,0,0]=4 542 B12R1.1 FCCCNc1ccc(cc1)Cl 34a_100000210052_100011934791 [1,0,1,0,0,0|2,0,0]=4 543 B12R1.1 FCCCNc1ccc(cc1)F 34a_100000185862_100011934791 [1,0,1,0,0,0|2,0,0]=4 544 B12R1.1 FCCCNc1ccc(cc1)I 34a_100000185761_100011934791 [1,0,1,0,0,0|2,0,0]=4 545 B12R1.1 Nc1ccc(cc1)OCCCO 34a_100000185829_100000230001 [1,0,1,0,0,0|2,0,0]=4 546 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100000185761_100011215043 [1,0,1,0,0,0|2,0,0]=4 547 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100011215043_100000185761 [1,0,1,0,0,0|2,0,0]=4 548 B12R1.1 OCCCNc1ccc(cc1)Br 2230a_100000210018_100000230001 [1,0,1,0,0,0|1,0,0]=3 549 B12R1.1 OCCCNc1ccc(cc1)Br 34a_100000210018_100000230001 [1,0,1,0,0,0|1,0,0]=3 550 B12R1.1 OCCCNc1ccc(cc1)Cl 2230a_100000210052_100000230001 [1,0,1,0,0,0|1,0,0]=3 551 B12R1.1 OCCCNc1ccc(cc1)Cl 34a_100000210052_100000230001 [1,0,1,0,0,0|1,0,0]=3 552 B12R1.1 OCCCNc1ccc(cc1)F 34a_100000185862_100000230001 [1,0,1,0,0,0|1,0,0]=3 553 B12R1.1 OCCCNc1ccc(cc1)I 34a_100000185761_100000230001 [1,0,1,0,0,0|1,0,0]=3 554 B12R1.1 OCCCNc1ccc(cc1)O 34a_100000185829_100000230001 [1,0,1,0,0,0|1,0,0]=3 555 B12R1.1 OCCCNc1ccc(cn1)Br 27a_100000182051_100000686858 [1,0,1,0,0,0|2,0,0]=4 556 B12R1.1 OCCCOc1ccc(cc1)Br 34a_100000185759_100000230001 [1,0,1,0,0,0|2,0,0]=4 557 B12R1.1 OCCCOc1ccc(cc1)Br 7a_100000185759_100011215043 [1,0,1,0,0,0|2,0,0]=4 558 B12R1.1 OCCCOc1ccc(cc1)Cl 34a_100000210216_100000230001 [1,0,1,0,0,0|2,0,0]=4 559 B12R1.1 OCCCOc1ccc(cc1)Cl 7a_100000210216_100011215043 [1,0,1,0,0,0|2,0,0]=4 560 B12R1.1 OCCCOc1ccc(cc1)F 34a_100000210339_100000230001 [1,0,1,0,0,0|2,0,0]=4 561 B12R1.1 OCCCOc1ccc(cc1)I 34a_100000212066_100000230001 [1,0,1,0,0,0|2,0,0]=4 562 B12R1.1 OCCCOc1ccc(cc1)I 7a_100000212066_100011215043 [1,0,1,0,0,0|2,0,0]=4 563 B12R1.1 OCCCOc1ccc(cc1)O 271570a_203496583355_100000756186 [1,0,1,0,0,0|2,0,0]=4 564 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100000752885_100011215043 [1,0,1,0,0,0|2,0,0]=4 565 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100011215043_100000752885 [1,0,1,0,0,0|2,0,0]=4 566 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100000755918_100011215043 [1,0,1,0,0,0|2,0,0]=4 567 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100011215043_100000755918 [1,0,1,0,0,0|2,0,0]=4 568 B12R1.1 OCCCSc1ccc(cc1)F 62a_100000211213_100011215043 [1,0,1,0,0,0|2,0,0]=4 569 B12R1.1 OCCCSc1ccc(cc1)F 62a_100011215043_100000211213 [1,0,1,0,0,0|2,0,0]=4 570 B12R1.1 OCCCSc1ccc(cc1)O 62a_100011215043_100000185759 [1,0,1,0,0,0|2,0,0]=4 571 B12R1.1 Oc1ccc(cc1)NCCCF 34a_100000185829_100011934791 [1,0,1,0,0,0|2,0,0]=4 572 B12R1.32 CC(CCO)Nc1ccccc1 34a_100000106764_100009893172 [1,0,1,0,0,0|0,0,0]=2 573 B12R1.32 CC(CCO)Oc1ccccc1 34a_100000210340_100009893172 [1,0,1,0,0,0|1,0,0]=3 574 B12R1.32 CC(CCO)Oc1ccccc1 7a_100000210340_100009893172 [1,0,1,0,0,0|1,0,0]=3 575 B12R1.32 CC(CCO)Oc1cccnc1 34a_100000210849_100009893172 [1,0,1,0,0,0|2,0,0]=4 576 B12R1.32 CC(CCO)Oc1cccnc1 7a_100000210849_100009893172 [1,0,1,0,0,0|2,0,0]=4 577 B12R1.32 CC(CCO)Oc1ccncc1 34a_100000212176_100009893172 [1,0,1,0,0,0|2,0,0]=4 578 B12R1.32 CC(CCO)Sc1ccccc1 62a_100000719477_100009893172 [1,0,1,0,0,0|1,0,0]=3 579 B12R1.32 CC(CCO)Sc1ccccc1 62a_100009893172_100000041952 [1,0,1,0,0,0|1,0,0]=3 580 B12R1.32 CC(CCO)Sc1ccccn1 62a_100009893172_100011216584 [1,0,1,0,0,0|2,0,0]=4 581 B12R1.32 CC(CCO)Sc1ccccn1 62a_100011216584_100009893172 [1,0,1,0,0,0|2,0,0]=4 582 B12R1.32 CC(CCO)Sc1cccnc1 62a_100000210063_100009893172 [1,0,1,0,0,0|2,0,0]=4 583 B12R1.32 CC(CCO)Sc1cccnc1 62a_100009893172_100000210063 [1,0,1,0,0,0|2,0,0]=4 584 B12R1.32 CC(CCO)Sc1ccncc1 62a_100000728582_100009893172 [1,0,1,0,0,0|2,0,0]=4 585 B12R1.32 CC(CCO)Sc1ccncc1 62a_100009893172_100000728582 [1,0,1,0,0,0|2,0,0]=4 586 B12R1.32 CCCC(C)Nc1ccccc1 34a_100000106764_100000766640 [1,0,1,0,0,0|1,0,0]=3 587 B12R1.32 CCCC(C)Oc1ccccc1 34a_100000210340_100000766640 [1,0,1,0,0,0|2,0,0]=4 588 B12R1.32 CCCC(C)Oc1ccccc1 7a_100000210340_100000766640 [1,0,1,0,0,0|2,0,0]=4 589 B12R1.32 CCCC(C)Sc1ccccc1 62a_100000719477_100000766640 [1,0,1,0,0,0|2,0,0]=4 590 B12R1.32 CCCC(C)Sc1ccccc1 62a_100000766640_100000041952 [1,0,1,0,0,0|2,0,0]=4 591 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000180844_200000210301 [1,0,1,0,0,0|2,0,0]=4 592 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000186898_100000211926 [1,0,1,0,0,0|2,0,0]=4 593 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000210263_100015291786 [1,0,1,0,0,0|2,0,0]=4 594 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000180844_200000210301 [1,0,1,0,0,0|2,0,0]=4 595 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000186898_100000211926 [1,0,1,0,0,0|2,0,0]=4 596 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000210263_100000211182 [1,0,1,0,0,0|2,0,0]=4 597 B12R1.32 CN(CCO)Cc1ccccc1 270004a_100000210263_100015611070 [1,0,1,0,0,0|2,0,0]=4 598 B12R1.32 COCC(C)Nc1ccccc1 34a_100000106764_100000765312 [1,0,1,0,0,0|2,0,0]=4 599 B12R1.32 C[C@H](CCO)Nc1cccnn1 27a_100000706166_100016991348 [1,0,1,0,0,0|2,0,0]=4 600 B12R1.32 C[C@H](CCO)Nc1ccncn1 27a_100000706166_100000703185 [1,0,1,0,0,0|2,0,0]=4 601 B12R1.32 C[C@H](CCO)Nc1cnccn1 27a_100000706166_100000211759 [1,0,1,0,0,0|2,0,0]=4 602 B12R1.32 C[C@H](CCO)Nc1ncccn1 27a_100000706166_100000211032 [1,0,1,0,0,0|2,0,0]=4 603 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [1,0,1,0,0,0|1,0,1]=4 604 B12R1.32 [13CH3]N(CCO)Cc1ccccc1 2230a_100000180844_200025704644 [1,0,1,0,0,0|2,0,0]=4 605 B12R1.32 [13CH3]N(CCO)Cc1ccccc1 269982a_100000180844_200025704644 [1,0,1,0,0,0|2,0,0]=4 606 B12R1.49 C#CC(C)Nc1ccc(cc1)C 34a_100000124888_200000035995 [1,0,1,0,0,0|0,0,2]=4 607 B12R1.49 CC(CO)Nc1ccc(cc1)Br 2230a_100000210018_100012180447 [1,0,1,0,0,0|1,0,0]=3 608 B12R1.49 CC(CO)Nc1ccc(cc1)Br 34a_100000210018_100012180447 [1,0,1,0,0,0|1,0,0]=3 609 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 2230a_100000210052_100012180447 [1,0,1,0,0,0|1,0,0]=3 610 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 34a_100000210052_100012180447 [1,0,1,0,0,0|1,0,0]=3 611 B12R1.49 CC(CO)Nc1ccc(cc1)F 34a_100000185862_100012180447 [1,0,1,0,0,0|1,0,0]=3 612 B12R1.49 CC(CO)Nc1ccc(cc1)I 34a_100000185761_100012180447 [1,0,1,0,0,0|1,0,0]=3 613 B12R1.49 CC(CO)Nc1ccc(cc1)O 34a_100000185829_100012180447 [1,0,1,0,0,0|1,0,0]=3 614 B12R1.49 CC(CO)Oc1ccc(cc1)Br 34a_100000185759_100012180447 [1,0,1,0,0,0|2,0,0]=4 615 B12R1.49 CC(CO)Oc1ccc(cc1)Br 7a_100000185759_100012180447 [1,0,1,0,0,0|2,0,0]=4 616 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 34a_100000210216_100012180447 [1,0,1,0,0,0|2,0,0]=4 617 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 7a_100000210216_100012180447 [1,0,1,0,0,0|2,0,0]=4 618 B12R1.49 CC(CO)Oc1ccc(cc1)F 34a_100000210339_100012180447 [1,0,1,0,0,0|2,0,0]=4 619 B12R1.49 CC(CO)Oc1ccc(cc1)I 34a_100000212066_100012180447 [1,0,1,0,0,0|2,0,0]=4 620 B12R1.49 CC(CO)Oc1ccc(cc1)I 7a_100000212066_100012180447 [1,0,1,0,0,0|2,0,0]=4 621 B12R1.49 CC(CO)Oc1ccc(cc1)N 34a_100000185829_100012180447 [1,0,1,0,0,0|2,0,0]=4 622 B12R1.49 CC(CO)Sc1ccc(cc1)Br 62a_100012180447_100000752885 [1,0,1,0,0,0|2,0,0]=4 623 B12R1.49 CC(CO)Sc1ccc(cc1)Cl 62a_100012180447_100000755918 [1,0,1,0,0,0|2,0,0]=4 624 B12R1.49 CC(CO)Sc1ccc(cc1)F 62a_100012180447_100000211213 [1,0,1,0,0,0|2,0,0]=4 625 B12R1.49 CC(CO)Sc1ccc(cc1)N 62a_100012180447_100000185761 [1,0,1,0,0,0|2,0,0]=4 626 B12R1.49 CC(CO)Sc1ccc(cc1)O 62a_100012180447_100000185759 [1,0,1,0,0,0|2,0,0]=4 627 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [1,0,1,0,0,0|1,0,1]=4 628 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [1,0,1,0,0,0|1,0,1]=4 629 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [1,0,1,0,0,0|1,0,1]=4 630 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [1,0,1,0,0,0|1,0,1]=4 631 B12R1.49 CCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000758301 [1,0,1,0,0,0|1,0,0]=3 632 B12R1.49 CCC(C)Nc1ccc(cc1)Br 34a_100000210018_100011215416 [1,0,1,0,0,0|1,0,0]=3 633 B12R1.49 CCC(C)Nc1ccc(cc1)C 34a_100000124888_100011215416 [1,0,1,0,0,0|0,0,0]=2 634 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000758301 [1,0,1,0,0,0|1,0,0]=3 635 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100011215416 [1,0,1,0,0,0|1,0,0]=3 636 B12R1.49 CCC(C)Nc1ccc(cc1)F 34a_100000185862_100011215416 [1,0,1,0,0,0|1,0,0]=3 637 B12R1.49 CCC(C)Nc1ccc(cc1)I 34a_100000185761_100011215416 [1,0,1,0,0,0|1,0,0]=3 638 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [1,0,1,0,0,0|1,0,0]=3 639 B12R1.49 CCC(C)Oc1ccc(cc1)Br 34a_100000185759_100011215416 [1,0,1,0,0,0|2,0,0]=4 640 B12R1.49 CCC(C)Oc1ccc(cc1)Br 7a_100000185759_100000758301 [1,0,1,0,0,0|2,0,0]=4 641 B12R1.49 CCC(C)Oc1ccc(cc1)C 34a_100000210336_100011215416 [1,0,1,0,0,0|1,0,0]=3 642 B12R1.49 CCC(C)Oc1ccc(cc1)C 7a_100000210336_100000758301 [1,0,1,0,0,0|1,0,0]=3 643 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 34a_100000210216_100011215416 [1,0,1,0,0,0|2,0,0]=4 644 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000758301 [1,0,1,0,0,0|2,0,0]=4 645 B12R1.49 CCC(C)Oc1ccc(cc1)F 34a_100000210339_100011215416 [1,0,1,0,0,0|2,0,0]=4 646 B12R1.49 CCC(C)Oc1ccc(cc1)I 34a_100000212066_100011215416 [1,0,1,0,0,0|2,0,0]=4 647 B12R1.49 CCC(C)Oc1ccc(cc1)I 7a_100000212066_100000758301 [1,0,1,0,0,0|2,0,0]=4 648 B12R1.49 CCC(C)Oc1ccc(cc1)N 34a_100000185829_100011215416 [1,0,1,0,0,0|2,0,0]=4 649 B12R1.49 CCC(C)Oc1ccc(cn1)C 34a_100000759353_100011215416 [1,0,1,0,0,0|2,0,0]=4 650 B12R1.49 CCC(C)Oc1ccc(nc1)C 34a_100000745506_100011215416 [1,0,1,0,0,0|2,0,0]=4 651 B12R1.49 CCC(C)Oc1ccc(nc1)C 7a_100000745506_100000758301 [1,0,1,0,0,0|2,0,0]=4 652 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000752885_100000758301 [1,0,1,0,0,0|2,0,0]=4 653 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000758301_100000752885 [1,0,1,0,0,0|2,0,0]=4 654 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000186775_100000758301 [1,0,1,0,0,0|1,0,0]=3 655 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000758301_100000186775 [1,0,1,0,0,0|1,0,0]=3 656 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000758301 [1,0,1,0,0,0|2,0,0]=4 657 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000758301_100000755918 [1,0,1,0,0,0|2,0,0]=4 658 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000211213_100000758301 [1,0,1,0,0,0|2,0,0]=4 659 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000758301_100000211213 [1,0,1,0,0,0|2,0,0]=4 660 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000185761_100000758301 [1,0,1,0,0,0|2,0,0]=4 661 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000758301_100000185761 [1,0,1,0,0,0|2,0,0]=4 662 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [1,0,1,0,0,0|2,0,0]=4 663 B12R1.49 CCC(C)Sc1ccc(cn1)C 62a_100000758301_100000754016 [1,0,1,0,0,0|2,0,0]=4 664 B12R1.49 CCC(C)Sc1ccc(cn1)C 62a_100011192072_100000758301 [1,0,1,0,0,0|2,0,0]=4 665 B12R1.49 CCC(C)Sc1ccc(nc1)C 62a_100000751577_100000758301 [1,0,1,0,0,0|2,0,0]=4 666 B12R1.49 CCC(C)Sc1ccc(nc1)C 62a_100000758301_100000751577 [1,0,1,0,0,0|2,0,0]=4 667 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [1,0,1,0,0,0|2,0,0]=4 668 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [1,0,1,0,0,0|2,0,0]=4 669 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [1,0,1,0,0,0|2,0,0]=4 670 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [1,0,1,0,0,0|2,0,0]=4 671 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [1,0,1,0,0,0|2,0,0]=4 672 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [1,0,1,0,0,0|2,0,0]=4 673 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [1,0,1,0,0,0|2,0,0]=4 674 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [1,0,1,0,0,0|2,0,0]=4 675 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [1,0,1,0,0,0|2,0,0]=4 676 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [1,0,1,0,0,0|2,0,0]=4 677 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [1,0,1,0,0,0|2,0,0]=4 678 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100000186775_100009879195 [1,0,1,0,0,0|2,0,0]=4 679 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100009879195_100000186775 [1,0,1,0,0,0|2,0,0]=4 680 B12R1.49 C[C@H](CO)Nc1ccc(cn1)Br 27a_100000737577_100000686858 [1,0,1,0,0,0|2,0,0]=4 681 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100000752885_100016084084 [1,0,1,0,0,0|2,0,0]=4 682 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100016084084_100000752885 [1,0,1,0,0,0|2,0,0]=4 683 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100000755918_100016084084 [1,0,1,0,0,0|2,0,0]=4 684 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100016084084_100000755918 [1,0,1,0,0,0|2,0,0]=4 685 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100000211213_100016084084 [1,0,1,0,0,0|2,0,0]=4 686 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100016084084_100000211213 [1,0,1,0,0,0|2,0,0]=4 687 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100000185761_100016084084 [1,0,1,0,0,0|2,0,0]=4 688 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100016084084_100000185761 [1,0,1,0,0,0|2,0,0]=4 689 B12R1.49 C[C@H](CO)Sc1ccc(cc1)O 62a_100016084084_100000185759 [1,0,1,0,0,0|2,0,0]=4 690 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [1,0,1,0,0,0|1,0,1]=4 691 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [1,0,1,0,0,0|1,0,1]=4 692 B12R1.49 Cc1ccc(cc1)NC(C)CO 34a_100000124888_100012180447 [1,0,1,0,0,0|0,0,0]=2 693 B12R1.49 Cc1ccc(cc1)OC(C)CO 34a_100000210336_100012180447 [1,0,1,0,0,0|1,0,0]=3 694 B12R1.49 Cc1ccc(cc1)OC(C)CO 7a_100000210336_100012180447 [1,0,1,0,0,0|1,0,0]=3 695 B12R1.49 Cc1ccc(cc1)SC(C)CO 62a_100012180447_100000186775 [1,0,1,0,0,0|1,0,0]=3 696 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100000186775_100016084084 [1,0,1,0,0,0|1,0,0]=3 697 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000186775 [1,0,1,0,0,0|1,0,0]=3 698 B12R1.49 Cc1ccc(cn1)OC(C)CO 34a_100000745506_100012180447 [1,0,1,0,0,0|2,0,0]=4 699 B12R1.49 Cc1ccc(cn1)OC(C)CO 7a_100000745506_100012180447 [1,0,1,0,0,0|2,0,0]=4 700 B12R1.49 Cc1ccc(cn1)SC(C)CO 62a_100012180447_100000751577 [1,0,1,0,0,0|2,0,0]=4 701 B12R1.49 Cc1ccc(cn1)S[C@H](C)CO 62a_100000751577_100016084084 [1,0,1,0,0,0|2,0,0]=4 702 B12R1.49 Cc1ccc(cn1)S[C@H](C)CO 62a_100016084084_100000751577 [1,0,1,0,0,0|2,0,0]=4 703 B12R1.49 Cc1ccc(nc1)OC(C)CO 34a_100000759353_100012180447 [1,0,1,0,0,0|2,0,0]=4 704 B12R1.49 Cc1ccc(nc1)SC(C)CO 62a_100012180447_100000754016 [1,0,1,0,0,0|2,0,0]=4 705 B12R1.49 Cc1ccc(nc1)S[C@H](C)CO 62a_100011192072_100016084084 [1,0,1,0,0,0|2,0,0]=4 706 B12R1.49 Cc1ccc(nc1)S[C@H](C)CO 62a_100016084084_100000754016 [1,0,1,0,0,0|2,0,0]=4 707 B12R1.49 Cc1ccc(nn1)N[C@H](C)CO 27a_100000737577_100000744512 [1,0,1,0,0,0|2,0,0]=4 708 B12R1.49 Cc1cnc(cn1)N[C@H](C)CO 27a_100000737577_100000074397 [1,0,1,0,0,0|2,0,0]=4 709 B12R1.49 Cc1cnc(nc1)N[C@H](C)CO 27a_100000737577_100000061069 [1,0,1,0,0,0|2,0,0]=4 710 B12R1.75 C#Cc1ccccc1NC(C)C 34a_100011470550_100000210206 [1,0,1,0,0,0|1,0,1]=4 711 B12R1.75 C=Cc1ccccc1NC(C)C 271570a_100011290941_100000219599 [1,0,1,0,0,0|1,0,1]=4 712 B12R1.75 C=Cc1ccccc1NC(C)C 34a_100012022501_100000210206 [1,0,1,0,0,0|1,0,1]=4 713 B12R1.75 CC(=Cc1ccccc1CO)C 271570a_100102525489_100000187465 [1,0,1,0,0,0|1,0,1]=4 714 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [1,0,1,0,0,0|1,0,1]=4 715 B12R1.75 CC(C)Nc1ccccc1C#N 34a_100000211148_100000210206 [1,0,1,0,0,0|1,0,1]=4 716 B12R1.75 CC(C)Nc1ccccc1CO 34a_100000212039_100000210206 [1,0,1,0,0,0|0,0,0]=2 717 B12R1.75 CC(C)Nc1ccccc1S[13CH3] 62a_100000219599_200025704644 [1,0,1,0,0,0|2,0,0]=4 718 B12R1.75 CC(C)Nc1ccccc1S[13CH3] 62a_200025704644_100000219599 [1,0,1,0,0,0|2,0,0]=4 719 B12R1.75 CC(C)Nc1ccncc1CO 27a_100138425928_100000117392 [1,0,1,0,0,0|1,0,0]=3 720 B12R1.75 CC(C)Oc1ccccc1CN 34a_100000185550_100000210206 [1,0,1,0,0,0|2,0,0]=4 721 B12R1.75 CC(C)Oc1ccccc1CO 34a_100011216872_100000210206 [1,0,1,0,0,0|1,0,0]=3 722 B12R1.75 CC(C)Oc1cccnc1CO 34a_100000731849_100000210206 [1,0,1,0,0,0|2,0,0]=4 723 B12R1.75 CC(C)Oc1cnccc1CO 34a_100000078615_100000210206 [1,0,1,0,0,0|2,0,0]=4 724 B12R1.75 CC(C)Sc1ccccc1CN 62a_100000210206_100000689332 [1,0,1,0,0,0|2,0,0]=4 725 B12R1.75 CC(C)Sc1ccccc1CN 62a_100000689332_100000210206 [1,0,1,0,0,0|2,0,0]=4 726 B12R1.75 CC(C)Sc1ccccc1CO 62a_100000187465_100000210206 [1,0,1,0,0,0|1,0,0]=3 727 B12R1.75 CC(C)Sc1ccccc1CO 62a_100000210206_100000187465 [1,0,1,0,0,0|1,0,0]=3 728 B12R1.75 CC(C)Sc1cccnc1CO 62a_100000210206_100011996772 [1,0,1,0,0,0|2,0,0]=4 729 B12R1.75 CC(C)Sc1cccnc1CO 62a_100011996772_100000210206 [1,0,1,0,0,0|2,0,0]=4 730 B12R1.75 CC(C)Sc1ccncc1CO 62a_100000117392_100000210206 [1,0,1,0,0,0|2,0,0]=4 731 B12R1.75 CC(C)Sc1ccncc1CO 62a_100000210206_100000117392 [1,0,1,0,0,0|2,0,0]=4 732 B12R1.75 CC(C)Sc1cnccc1CO 62a_100000210206_100009873359 [1,0,1,0,0,0|2,0,0]=4 733 B12R1.75 CC(C)Sc1cnccc1CO 62a_100009873359_100000210206 [1,0,1,0,0,0|2,0,0]=4 734 B12R1.75 CC(C)Sc1ncccc1CO 62a_100000210206_100000748726 [1,0,1,0,0,0|2,0,0]=4 735 B12R1.75 CC(C)Sc1ncccc1CO 62a_100000748726_100000210206 [1,0,1,0,0,0|2,0,0]=4 736 B12R1.75 CCc1ccccc1NC(C)C 2230a_100000212081_100000210206 [1,0,1,0,0,0|1,0,0]=3 737 B12R1.75 CCc1ccccc1NC(C)C 34a_100000212081_100000210206 [1,0,1,0,0,0|1,0,0]=3 738 B12R1.75 CCc1ccccc1NC(C)C 7a_100000212081_100000210206 [1,0,1,0,0,0|1,0,0]=3 739 B12R1.75 CCc1ccccc1OC(C)C 34a_100000210936_100000210206 [1,0,1,0,0,0|2,0,0]=4 740 B12R1.75 CCc1ccccc1OC(C)C 7a_100000210936_100000210206 [1,0,1,0,0,0|2,0,0]=4 741 B12R1.75 CCc1ccccc1SC(C)C 62a_100000210206_100011215823 [1,0,1,0,0,0|2,0,0]=4 742 B12R1.75 CCc1ccccc1SC(C)C 62a_100011215823_100000210206 [1,0,1,0,0,0|2,0,0]=4 743 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100000044721_200000210301 [1,0,1,0,0,0|2,0,0]=4 744 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100102631434_100009816955 [1,0,1,0,0,0|2,0,0]=4 745 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100000044721_200000210301 [1,0,1,0,0,0|2,0,0]=4 746 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100102631434_100009816955 [1,0,1,0,0,0|2,0,0]=4 747 B12R1.75 CN([13CH3])Cc1ccccc1CO 2230a_100000044721_200025704644 [1,0,1,0,0,0|2,0,0]=4 748 B12R1.75 CN([13CH3])Cc1ccccc1CO 269982a_100000044721_200025704644 [1,0,1,0,0,0|2,0,0]=4 749 B12R1.75 COc1ccccc1NC(C)C 34a_100000210025_100000210206 [1,0,1,0,0,0|2,0,0]=4 750 B12R1.75 CSc1ccccc1NC(C)C 34a_100000211160_100000210206 [1,0,1,0,0,0|2,0,0]=4 751 B12R1.75 CSc1ccccc1NC(C)C 62a_100000219599_200000210301 [1,0,1,0,0,0|2,0,0]=4 752 B12R1.75 CSc1ccccc1NC(C)C 62a_200000210301_100000219599 [1,0,1,0,0,0|2,0,0]=4 753 B12R1.112 C#Cc1cc(ccc1NCC)C 34a_200012001881_100000210202 [1,0,1,0,0,0|0,0,2]=4 754 B12R1.112 CC=Cc1ccc(cc1CO)C 271570a_100016259895_100012361352 [1,0,1,0,0,0|1,0,1]=4 755 B12R1.112 CCNc1ccc(cc1C#N)C 7a_100011934023_100000210202 [1,0,1,0,0,0|1,0,1]=4 756 B12R1.112 CCNc1ccc(cc1CC)Br 2230a_100000686106_100000210202 [1,0,1,0,0,0|1,0,0]=3 757 B12R1.112 CCNc1ccc(cc1CC)Br 34a_100000686106_100000210202 [1,0,1,0,0,0|1,0,0]=3 758 B12R1.112 CCNc1ccc(cc1CC)Br 7a_100000686106_100000210202 [1,0,1,0,0,0|1,0,0]=3 759 B12R1.112 CCNc1ccc(cc1CC)Cl 2230a_100012017146_100000210202 [1,0,1,0,0,0|1,0,0]=3 760 B12R1.112 CCNc1ccc(cc1CC)Cl 34a_100012017146_100000210202 [1,0,1,0,0,0|1,0,0]=3 761 B12R1.112 CCNc1ccc(cc1CC)Cl 7a_100012017146_100000210202 [1,0,1,0,0,0|1,0,0]=3 762 B12R1.112 CCNc1ccc(cc1CC)I 2230a_100000014069_100000210202 [1,0,1,0,0,0|1,0,0]=3 763 B12R1.112 CCNc1ccc(cc1CC)I 34a_100000014069_100000210202 [1,0,1,0,0,0|1,0,0]=3 764 B12R1.112 CCNc1ccc(cc1CC)I 7a_100000014069_100000210202 [1,0,1,0,0,0|1,0,0]=3 765 B12R1.112 CCNc1ccc(cc1CO)Br 34a_100012353972_100000210202 [1,0,1,0,0,0|1,0,0]=3 766 B12R1.112 CCNc1ccc(cc1CO)C 34a_100011215565_100000210202 [1,0,1,0,0,0|0,0,0]=2 767 B12R1.112 CCNc1ccc(cc1CO)Cl 34a_100011214999_100000210202 [1,0,1,0,0,0|1,0,0]=3 768 B12R1.112 CCNc1ccc(cc1CO)F 34a_100011296978_100000210202 [1,0,1,0,0,0|1,0,0]=3 769 B12R1.112 CCNc1ccc(cc1OC)Br 34a_100011279103_100000210202 [1,0,1,0,0,0|2,0,0]=4 770 B12R1.112 CCNc1ccc(cc1OC)C 2230a_100000746441_100000210202 [1,0,1,0,0,0|1,0,0]=3 771 B12R1.112 CCNc1ccc(cc1OC)C 34a_100000746441_100000210202 [1,0,1,0,0,0|1,0,0]=3 772 B12R1.112 CCNc1ccc(cc1OC)Cl 34a_100000707585_100000210202 [1,0,1,0,0,0|2,0,0]=4 773 B12R1.112 CCNc1ccc(cc1OC)F 34a_100000737216_100000210202 [1,0,1,0,0,0|2,0,0]=4 774 B12R1.112 CCNc1ccc(cc1OC)I 34a_100015196925_100000210202 [1,0,1,0,0,0|2,0,0]=4 775 B12R1.112 CCNc1ccc(cc1OC)O 34a_100015326901_100000210202 [1,0,1,0,0,0|2,0,0]=4 776 B12R1.112 CCNc1ncc(cc1SC)C 27a_100015525214_100010884634 [1,0,1,0,0,0|2,0,0]=4 777 B12R1.112 CCOc1ccc(cc1CC)Br 34a_100012338938_100000210202 [1,0,1,0,0,0|2,0,0]=4 778 B12R1.112 CCOc1ccc(cc1CC)Br 7a_100012338938_100000210202 [1,0,1,0,0,0|2,0,0]=4 779 B12R1.112 CCOc1ccc(cc1CC)C 34a_100009844793_100000210202 [1,0,1,0,0,0|1,0,0]=3 780 B12R1.112 CCOc1ccc(cc1CC)C 7a_100009844793_100000210202 [1,0,1,0,0,0|1,0,0]=3 781 B12R1.112 CCOc1ccc(cc1CC)F 34a_200000035566_100000210202 [1,0,1,0,0,0|2,0,0]=4 782 B12R1.112 CCOc1ccc(cc1CC)F 7a_200000035566_100000210202 [1,0,1,0,0,0|2,0,0]=4 783 B12R1.112 CCOc1ccc(cc1CC)O 271570a_203496583355_200010070707 [1,0,1,0,0,0|2,0,0]=4 784 B12R1.112 CCOc1ccc(cc1CO)Br 34a_100000184703_100000210202 [1,0,1,0,0,0|2,0,0]=4 785 B12R1.112 CCOc1ccc(cc1CO)Br 7a_100000184703_100000210202 [1,0,1,0,0,0|2,0,0]=4 786 B12R1.112 CCOc1ccc(cc1CO)C 34a_200011846009_100000210202 [1,0,1,0,0,0|1,0,0]=3 787 B12R1.112 CCOc1ccc(cc1CO)C 7a_200011846009_100000210202 [1,0,1,0,0,0|1,0,0]=3 788 B12R1.112 CCOc1ccc(cc1CO)Cl 34a_100011218961_100000210202 [1,0,1,0,0,0|2,0,0]=4 789 B12R1.112 CCOc1ccc(cc1CO)Cl 7a_100011218961_100000210202 [1,0,1,0,0,0|2,0,0]=4 790 B12R1.112 CCOc1ccc(cc1CO)F 34a_100011291448_100000210202 [1,0,1,0,0,0|2,0,0]=4 791 B12R1.112 CCOc1ccc(cc1CO)F 7a_100011291448_100000210202 [1,0,1,0,0,0|2,0,0]=4 792 B12R1.112 CCOc1ccc(cc1CO)I 34a_100000049520_100000210202 [1,0,1,0,0,0|2,0,0]=4 793 B12R1.112 CCOc1ccc(cc1CO)I 7a_100000049520_100000210202 [1,0,1,0,0,0|2,0,0]=4 794 B12R1.112 CCOc1ccc(cc1NC)C 2230a_100011202655_200000210301 [1,0,1,0,0,0|2,0,0]=4 795 B12R1.112 CCOc1ccc(cc1NC)C 34a_100011202655_200000210301 [1,0,1,0,0,0|2,0,0]=4 796 B12R1.112 CCOc1ccc(cc1N[13CH3])C 2230a_100011202655_200025704644 [1,0,1,0,0,0|2,0,0]=4 797 B12R1.112 CCOc1ccc(cc1N[13CH3])C 34a_100011202655_200025704644 [1,0,1,0,0,0|2,0,0]=4 798 B12R1.112 CCOc1ccc(cc1OC)C 34a_100000186466_100000210202 [1,0,1,0,0,0|2,0,0]=4 799 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000210301_200000230997 [1,0,1,0,0,0|2,0,0]=4 800 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000230997_200000210301 [1,0,1,0,0,0|2,0,0]=4 801 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200000230997_200025704644 [1,0,1,0,0,0|2,0,0]=4 802 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200025704644_200000230997 [1,0,1,0,0,0|2,0,0]=4 803 B12R1.112 CCOc1ccc(nc1CC)C 34a_100000718140_100000210202 [1,0,1,0,0,0|2,0,0]=4 804 B12R1.112 CCOc1ccc(nc1CC)C 7a_100000718140_100000210202 [1,0,1,0,0,0|2,0,0]=4 805 B12R1.112 CCOc1ccc(nc1CO)C 34a_100000751967_100000210202 [1,0,1,0,0,0|2,0,0]=4 806 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100000210202_100011216195 [1,0,1,0,0,0|2,0,0]=4 807 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100011216195_100000210202 [1,0,1,0,0,0|2,0,0]=4 808 B12R1.112 CCSc1ccc(cc1CC)N 62a_100000210202_100010109747 [1,0,1,0,0,0|2,0,0]=4 809 B12R1.112 CCSc1ccc(cc1CC)N 62a_100010109747_100000210202 [1,0,1,0,0,0|2,0,0]=4 810 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100000210202_100011356890 [1,0,1,0,0,0|2,0,0]=4 811 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100011356890_100000210202 [1,0,1,0,0,0|2,0,0]=4 812 B12R1.112 CCSc1ccc(cc1CO)C 62a_100000210202_100012361352 [1,0,1,0,0,0|1,0,0]=3 813 B12R1.112 CCSc1ccc(cc1CO)C 62a_100012361352_100000210202 [1,0,1,0,0,0|1,0,0]=3 814 B12R1.112 CCSc1ccc(cc1CO)F 62a_100000210202_100011217561 [1,0,1,0,0,0|2,0,0]=4 815 B12R1.112 CCSc1ccc(cc1CO)F 62a_100011217561_100000210202 [1,0,1,0,0,0|2,0,0]=4 816 B12R1.112 CCSc1ccc(cc1CO)N 62a_100000210202_100012347228 [1,0,1,0,0,0|2,0,0]=4 817 B12R1.112 CCSc1ccc(cc1CO)N 62a_100012347228_100000210202 [1,0,1,0,0,0|2,0,0]=4 818 B12R1.112 CCSc1ccc(cc1CO)O 62a_100000210202_100012351483 [1,0,1,0,0,0|2,0,0]=4 819 B12R1.112 CCSc1ccc(cc1CO)O 62a_100012351483_100000210202 [1,0,1,0,0,0|2,0,0]=4 820 B12R1.112 CCSc1ccc(cc1OC)C 62a_100000210202_100010200004 [1,0,1,0,0,0|2,0,0]=4 821 B12R1.112 CCSc1ccc(cc1OC)C 62a_100010200004_100000210202 [1,0,1,0,0,0|2,0,0]=4 822 B12R1.112 CCSc1ccc(cc1SC)C 62a_100000210202_200010709736 [1,0,1,0,0,0|2,0,0]=4 823 B12R1.112 CCSc1ccc(cc1SC)C 62a_200010709736_100000210202 [1,0,1,0,0,0|2,0,0]=4 824 B12R1.112 CCSc1ccc(nc1CO)C 62a_100000210202_100010074375 [1,0,1,0,0,0|2,0,0]=4 825 B12R1.112 CCSc1ccc(nc1CO)C 62a_100010074375_100000210202 [1,0,1,0,0,0|2,0,0]=4 826 B12R1.112 CCSc1cnc(cc1CO)C 62a_100000210202_100015579599 [1,0,1,0,0,0|2,0,0]=4 827 B12R1.112 CCSc1cnc(cc1CO)C 62a_100015579599_100000210202 [1,0,1,0,0,0|2,0,0]=4 828 B12R1.112 CCSc1ncc(cc1CO)C 62a_100000118064_100000210202 [1,0,1,0,0,0|2,0,0]=4 829 B12R1.112 CCSc1ncc(cc1CO)C 62a_100000210202_100000118064 [1,0,1,0,0,0|2,0,0]=4 830 B12R1.112 CCc1cc(ccc1NCF)Br 34a_100000686106_100015361967 [1,0,1,0,0,0|2,0,0]=4 831 B12R1.112 CCc1cc(ccc1NCF)Br 7a_100000686106_100015361967 [1,0,1,0,0,0|2,0,0]=4 832 B12R1.112 CCc1cc(ccc1NCF)Cl 34a_100012017146_100015361967 [1,0,1,0,0,0|2,0,0]=4 833 B12R1.112 CCc1cc(ccc1NCF)Cl 7a_100012017146_100015361967 [1,0,1,0,0,0|2,0,0]=4 834 B12R1.112 CCc1cc(ccc1NCF)I 34a_100000014069_100015361967 [1,0,1,0,0,0|2,0,0]=4 835 B12R1.112 CCc1cc(ccc1NCF)I 7a_100000014069_100015361967 [1,0,1,0,0,0|2,0,0]=4 836 B12R1.112 CCc1cc(ccc1OCF)C 34a_100009844793_100015361967 [1,0,1,0,0,0|2,0,0]=4 837 B12R1.112 CCc1cc(ccc1OCF)C 7a_100009844793_100015361967 [1,0,1,0,0,0|2,0,0]=4 838 B12R1.112 COc1cc(ccc1NCF)C 34a_100000746441_100015361967 [1,0,1,0,0,0|2,0,0]=4 839 B12R1.112 Cc1ccc(c(c1)CO)NCF 34a_100011215565_100015361967 [1,0,1,0,0,0|1,0,0]=3 840 B12R1.112 Cc1ccc(c(c1)CO)OCF 34a_200011846009_100015361967 [1,0,1,0,0,0|2,0,0]=4 841 B12R1.112 Cc1ccc(c(c1)CO)OCF 7a_200011846009_100015361967 [1,0,1,0,0,0|2,0,0]=4 842 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100012361352_100015361967 [1,0,1,0,0,0|2,0,0]=4 843 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100015361967_100012361352 [1,0,1,0,0,0|2,0,0]=4 844 B12R1.112 OCc1cc(ccc1NCF)Br 34a_100012353972_100015361967 [1,0,1,0,0,0|2,0,0]=4 845 B12R1.112 OCc1cc(ccc1NCF)Cl 34a_100011214999_100015361967 [1,0,1,0,0,0|2,0,0]=4 846 B12R1.112 OCc1cc(ccc1NCF)F 34a_100011296978_100015361967 [1,0,1,0,0,0|2,0,0]=4 847 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [1,0,1,0,0,0|1,0,1]=4 848 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [1,0,1,0,0,0|1,0,1]=4 849 B12R1.233 CC(=O)Nc1ccc(cc1C)C 11a_100000736561_100015343762 [1,0,1,0,0,0|1,0,1]=4 850 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100015343762 [1,0,1,0,0,0|1,0,1]=4 851 B12R1.233 CC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000070787 [1,0,1,0,0,0|1,0,1]=4 852 B12R1.233 CC(=O)Nc1ccc(cc1C)C 527a_100000736561_100103153847 [1,0,1,0,0,0|1,0,1]=4 853 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [1,0,1,0,0,0|1,0,1]=4 854 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [1,0,1,0,0,0|1,0,1]=4 855 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [1,0,1,0,0,0|1,0,1]=4 856 B12R1.233 CC(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000210206 [1,0,1,0,0,0|2,0,0]=4 857 B12R1.233 CC(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000210206 [1,0,1,0,0,0|2,0,0]=4 858 B12R1.233 CC(C)Nc1ccc(cc1Br)F 34a_100000738039_100000210206 [1,0,1,0,0,0|2,0,0]=4 859 B12R1.233 CC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210206 [1,0,1,0,0,0|2,0,0]=4 860 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000210206 [1,0,1,0,0,0|2,0,0]=4 861 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000210206 [1,0,1,0,0,0|2,0,0]=4 862 B12R1.233 CC(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000210206 [1,0,1,0,0,0|2,0,0]=4 863 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000210206 [1,0,1,0,0,0|2,0,0]=4 864 B12R1.233 CC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210206 [1,0,1,0,0,0|2,0,0]=4 865 B12R1.233 CC(C)Nc1ccc(cc1F)Br 34a_100000210722_100000210206 [1,0,1,0,0,0|2,0,0]=4 866 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000210206 [1,0,1,0,0,0|2,0,0]=4 867 B12R1.233 CC(C)Nc1ccc(cc1F)F 34a_100000210720_100000210206 [1,0,1,0,0,0|2,0,0]=4 868 B12R1.233 CC(C)Nc1ccc(cc1F)I 34a_100011215594_100000210206 [1,0,1,0,0,0|2,0,0]=4 869 B12R1.233 CC(C)Nc1ccc(cc1F)O 34a_100000759473_100000210206 [1,0,1,0,0,0|2,0,0]=4 870 B12R1.233 CC(C)Nc1ccc(cc1I)Br 34a_100000187925_100000210206 [1,0,1,0,0,0|2,0,0]=4 871 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000210206 [1,0,1,0,0,0|2,0,0]=4 872 B12R1.233 CC(C)Nc1ccc(cc1I)F 34a_100000760547_100000210206 [1,0,1,0,0,0|2,0,0]=4 873 B12R1.233 CC(C)Nc1ccc(cc1I)O 34a_100010084370_100000210206 [1,0,1,0,0,0|2,0,0]=4 874 B12R1.233 CC(C)Nc1ccc(cc1O)Br 34a_100000739049_100000210206 [1,0,1,0,0,0|1,0,0]=3 875 B12R1.233 CC(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000210206 [1,0,1,0,0,0|1,0,0]=3 876 B12R1.233 CC(C)Nc1ccc(cc1O)F 34a_100000753323_100000210206 [1,0,1,0,0,0|1,0,0]=3 877 B12R1.233 CC(C)Nc1ccc(cc1O)O 34a_100000106777_100000210206 [1,0,1,0,0,0|1,0,0]=3 878 B12R1.233 CC(C)Oc1ccc(cc1O)F 271570a_203496583355_100000171696 [1,0,1,0,0,0|2,0,0]=4 879 B12R1.233 CC(C)Oc1ccc(cc1O)N 271570a_203496583355_200000706018 [1,0,1,0,0,0|2,0,0]=4 880 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100000210206_100012344904 [1,0,1,0,0,0|2,0,0]=4 881 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100012344904_100000210206 [1,0,1,0,0,0|2,0,0]=4 882 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000050036_100000210206 [1,0,1,0,0,0|2,0,0]=4 883 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000210206_100000050036 [1,0,1,0,0,0|2,0,0]=4 884 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000210206_100000690578 [1,0,1,0,0,0|2,0,0]=4 885 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000690578_100000210206 [1,0,1,0,0,0|2,0,0]=4 886 B12R1.233 CC(C)Sc1ccc(cc1O)O 62a_100000210206_100009813921 [1,0,1,0,0,0|2,0,0]=4 887 B12R1.233 Cc1cc(c(cn1)OC(C)C)C 34a_200000068632_100000210206 [1,0,1,0,0,0|2,0,0]=4 888 B12R1.233 Cc1cc(c(cn1)OC(C)C)C 7a_200000068632_100000210206 [1,0,1,0,0,0|2,0,0]=4 889 B12R1.233 Cc1cc(c(cn1)SC(C)C)C 62a_100000210206_100009819613 [1,0,1,0,0,0|2,0,0]=4 890 B12R1.233 Cc1cc(c(cn1)SC(C)C)C 62a_100009819613_100000210206 [1,0,1,0,0,0|2,0,0]=4 891 B12R1.233 Cc1cc(c(cn1)SC(C)C)O 62a_100000210206_100011016184 [1,0,1,0,0,0|2,0,0]=4 892 B12R1.233 Cc1cc(c(cn1)SC(C)C)O 62a_100011016184_100000210206 [1,0,1,0,0,0|2,0,0]=4 893 B12R1.233 Cc1cc(ccc1NC(C)C)Br 34a_100000211769_100000210206 [1,0,1,0,0,0|1,0,0]=3 894 B12R1.233 Cc1cc(ccc1NC(C)C)Br 7a_100000211769_100000210206 [1,0,1,0,0,0|1,0,0]=3 895 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 34a_100000210418_100000210206 [1,0,1,0,0,0|1,0,0]=3 896 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 7a_100000210418_100000210206 [1,0,1,0,0,0|1,0,0]=3 897 B12R1.233 Cc1cc(ccc1NC(C)C)F 34a_100000211637_100000210206 [1,0,1,0,0,0|1,0,0]=3 898 B12R1.233 Cc1cc(ccc1NC(C)C)F 7a_100000211637_100000210206 [1,0,1,0,0,0|1,0,0]=3 899 B12R1.233 Cc1cc(ccc1NC(C)C)I 34a_100000184554_100000210206 [1,0,1,0,0,0|1,0,0]=3 900 B12R1.233 Cc1cc(ccc1NC(C)C)I 7a_100000184554_100000210206 [1,0,1,0,0,0|1,0,0]=3 901 B12R1.233 Cc1cc(ccc1NC(C)C)O 34a_100000756630_100000210206 [1,0,1,0,0,0|1,0,0]=3 902 B12R1.233 Cc1cc(ccc1OC(C)C)Br 34a_100000186361_100000210206 [1,0,1,0,0,0|2,0,0]=4 903 B12R1.233 Cc1cc(ccc1OC(C)C)Br 7a_100000186361_100000210206 [1,0,1,0,0,0|2,0,0]=4 904 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 34a_100000211091_100000210206 [1,0,1,0,0,0|2,0,0]=4 905 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 7a_100000211091_100000210206 [1,0,1,0,0,0|2,0,0]=4 906 B12R1.233 Cc1cc(ccc1OC(C)C)F 34a_100000764316_100000210206 [1,0,1,0,0,0|2,0,0]=4 907 B12R1.233 Cc1cc(ccc1OC(C)C)F 7a_100000764316_100000210206 [1,0,1,0,0,0|2,0,0]=4 908 B12R1.233 Cc1cc(ccc1OC(C)C)I 34a_100011218673_100000210206 [1,0,1,0,0,0|2,0,0]=4 909 B12R1.233 Cc1cc(ccc1OC(C)C)I 7a_100011218673_100000210206 [1,0,1,0,0,0|2,0,0]=4 910 B12R1.233 Cc1cc(ccc1OC(C)C)N 34a_100011218179_100000210206 [1,0,1,0,0,0|2,0,0]=4 911 B12R1.233 Cc1cc(ccc1OC(C)C)N 7a_100011218179_100000210206 [1,0,1,0,0,0|2,0,0]=4 912 B12R1.233 Cc1cc(ccc1OC(C)C)O 271570a_203496583355_200011825982 [1,0,1,0,0,0|2,0,0]=4 913 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000210206_100000701812 [1,0,1,0,0,0|2,0,0]=4 914 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000701812_100000210206 [1,0,1,0,0,0|2,0,0]=4 915 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100000210206_100011219607 [1,0,1,0,0,0|2,0,0]=4 916 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100011219607_100000210206 [1,0,1,0,0,0|2,0,0]=4 917 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100000210206_100011205405 [1,0,1,0,0,0|2,0,0]=4 918 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100011205405_100000210206 [1,0,1,0,0,0|2,0,0]=4 919 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210206_100000210723 [1,0,1,0,0,0|2,0,0]=4 920 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210723_100000210206 [1,0,1,0,0,0|2,0,0]=4 921 B12R1.233 Cc1cc(ccc1SC(C)C)O 62a_100000210206_100000690111 [1,0,1,0,0,0|2,0,0]=4 922 B12R1.233 Cc1ccc(c(c1)Br)NC(C)C 34a_100000210942_100000210206 [1,0,1,0,0,0|1,0,0]=3 923 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 34a_100000210800_100000210206 [1,0,1,0,0,0|2,0,0]=4 924 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 7a_100000210800_100000210206 [1,0,1,0,0,0|2,0,0]=4 925 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100009813563 [1,0,1,0,0,0|2,0,0]=4 926 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100009813563_100000210206 [1,0,1,0,0,0|2,0,0]=4 927 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [1,0,1,0,0,0|2,0,0]=4 928 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [1,0,1,0,0,0|2,0,0]=4 929 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [1,0,1,0,0,0|2,0,0]=4 930 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [1,0,1,0,0,0|2,0,0]=4 931 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [1,0,1,0,0,0|2,0,0]=4 932 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [1,0,1,0,0,0|2,0,0]=4 933 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [1,0,1,0,0,0|2,0,0]=4 934 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [1,0,1,0,0,0|2,0,0]=4 935 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [1,0,1,0,0,0|2,0,0]=4 936 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 34a_100000736561_100000210206 [1,0,1,0,0,0|0,0,0]=2 937 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 7a_100000736561_100000210206 [1,0,1,0,0,0|0,0,0]=2 938 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 34a_100000211776_100000210206 [1,0,1,0,0,0|1,0,0]=3 939 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 7a_100000211776_100000210206 [1,0,1,0,0,0|1,0,0]=3 940 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100000210206_100011217332 [1,0,1,0,0,0|1,0,0]=3 941 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100011217332_100000210206 [1,0,1,0,0,0|1,0,0]=3 942 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C 34a_100000210522_100000210206 [1,0,1,0,0,0|1,0,0]=3 943 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 34a_100000749699_100000210206 [1,0,1,0,0,0|2,0,0]=4 944 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 7a_100000749699_100000210206 [1,0,1,0,0,0|2,0,0]=4 945 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100000210206_100011263221 [1,0,1,0,0,0|2,0,0]=4 946 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100011263221_100000210206 [1,0,1,0,0,0|2,0,0]=4 947 B12R1.233 Cc1ccc(c(c1)F)NC(C)C 34a_100000211023_100000210206 [1,0,1,0,0,0|1,0,0]=3 948 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 34a_100011216688_100000210206 [1,0,1,0,0,0|2,0,0]=4 949 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 7a_100011216688_100000210206 [1,0,1,0,0,0|2,0,0]=4 950 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100000210206_100011216119 [1,0,1,0,0,0|2,0,0]=4 951 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100011216119_100000210206 [1,0,1,0,0,0|2,0,0]=4 952 B12R1.233 Cc1ccc(c(c1)I)NC(C)C 34a_100011356834_100000210206 [1,0,1,0,0,0|1,0,0]=3 953 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 34a_100000765521_100000210206 [1,0,1,0,0,0|2,0,0]=4 954 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 7a_100000765521_100000210206 [1,0,1,0,0,0|2,0,0]=4 955 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 34a_100011215204_100000210206 [1,0,1,0,0,0|2,0,0]=4 956 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 7a_100011215204_100000210206 [1,0,1,0,0,0|2,0,0]=4 957 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100000210206_100011216686 [1,0,1,0,0,0|2,0,0]=4 958 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100011216686_100000210206 [1,0,1,0,0,0|2,0,0]=4 959 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [1,0,1,0,0,0|0,0,0]=2 960 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [1,0,1,0,0,0|1,0,0]=3 961 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [1,0,1,0,0,0|1,0,0]=3 962 B12R1.233 Cc1ccc(c(n1)C)OC(C)C 34a_100011218912_100000210206 [1,0,1,0,0,0|2,0,0]=4 963 B12R1.233 Cc1ccc(c(n1)C)OC(C)C 7a_100011218912_100000210206 [1,0,1,0,0,0|2,0,0]=4 964 B12R1.233 Cc1ccc(c(n1)C)SC(C)C 62a_100000210206_100009813853 [1,0,1,0,0,0|2,0,0]=4 965 B12R1.233 Cc1ccc(c(n1)C)SC(C)C 62a_100009813853_100000210206 [1,0,1,0,0,0|2,0,0]=4 966 B12R1.233 Cc1ccc(c(n1)O)SC(C)C 62a_100000210206_100009817604 [1,0,1,0,0,0|2,0,0]=4 967 B12R1.233 Cc1ccc(c(n1)O)SC(C)C 62a_100009817604_100000210206 [1,0,1,0,0,0|2,0,0]=4 968 B12R1.233 Cc1cnc(c(c1)C)SC(C)C 62a_100000210206_100009864548 [1,0,1,0,0,0|2,0,0]=4 969 B12R1.233 Cc1cnc(c(c1)C)SC(C)C 62a_100009864548_100000210206 [1,0,1,0,0,0|2,0,0]=4 970 B12R1.233 Cc1cnc(c(c1)O)OC(C)C 271570a_203496583355_200012348018 [1,0,1,0,0,0|2,0,0]=4 971 B12R1.233 Cc1cnc(c(c1)O)SC(C)C 62a_100000210206_100012000487 [1,0,1,0,0,0|2,0,0]=4 972 B12R1.374 CCCCc1cc(ccc1Br)Br 271570a_100020621405_100011483371 [1,0,1,0,0,0|2,0,0]=4 973 B12R1.374 CCCCc1cc(ccc1Br)C 271570a_100020621405_100012353751 [1,0,1,0,0,0|1,0,0]=3 974 B12R1.374 CCCCc1cc(ccc1Br)Cl 271570a_100020621405_100012339723 [1,0,1,0,0,0|2,0,0]=4 975 B12R1.374 CCCCc1cc(ccc1Br)F 271570a_100020621405_100011217576 [1,0,1,0,0,0|2,0,0]=4 976 B12R1.374 CCCCc1cc(ccc1Br)N 271570a_100020621405_100000750459 [1,0,1,0,0,0|2,0,0]=4 977 B12R1.374 CCCCc1cc(ccc1Br)O 271570a_100020621405_100012339312 [1,0,1,0,0,0|2,0,0]=4 978 B12R1.374 CCCCc1cc(ccc1C)Br 271570a_100020621405_100011344865 [1,0,1,0,0,0|2,0,0]=4 979 B12R1.374 CCCCc1cc(ccc1C)C 271570a_100020621405_100000210833 [1,0,1,0,0,0|1,0,0]=3 980 B12R1.374 CCCCc1cc(ccc1C)Cl 271570a_100020621405_100011263213 [1,0,1,0,0,0|2,0,0]=4 981 B12R1.374 CCCCc1cc(ccc1C)F 271570a_100020621405_100011218078 [1,0,1,0,0,0|2,0,0]=4 982 B12R1.374 CCCCc1cc(ccc1C)N 271570a_100020621405_100000736455 [1,0,1,0,0,0|2,0,0]=4 983 B12R1.374 CCCCc1cc(ccc1C)O 271570a_100020621405_100011380479 [1,0,1,0,0,0|2,0,0]=4 984 B12R1.374 CCCCc1cc(ccc1Cl)Br 271570a_100020621405_100011772130 [1,0,1,0,0,0|2,0,0]=4 985 B12R1.374 CCCCc1cc(ccc1Cl)C 271570a_100020621405_100012356289 [1,0,1,0,0,0|1,0,0]=3 986 B12R1.374 CCCCc1cc(ccc1Cl)Cl 271570a_100020621405_100000707729 [1,0,1,0,0,0|2,0,0]=4 987 B12R1.374 CCCCc1cc(ccc1Cl)F 271570a_100020621405_100011217299 [1,0,1,0,0,0|2,0,0]=4 988 B12R1.374 CCCCc1cc(ccc1Cl)N 271570a_100020621405_100012360549 [1,0,1,0,0,0|2,0,0]=4 989 B12R1.374 CCCCc1cc(ccc1Cl)O 271570a_100020621405_100000049588 [1,0,1,0,0,0|2,0,0]=4 990 B12R1.374 CCCCc1cc(ccc1F)Br 271570a_100020621405_100011217312 [1,0,1,0,0,0|2,0,0]=4 991 B12R1.374 CCCCc1cc(ccc1F)C 271570a_100020621405_100000736223 [1,0,1,0,0,0|1,0,0]=3 992 B12R1.374 CCCCc1cc(ccc1F)Cl 271570a_100020621405_100011218116 [1,0,1,0,0,0|2,0,0]=4 993 B12R1.374 CCCCc1cc(ccc1F)F 271570a_100020621405_100000750033 [1,0,1,0,0,0|2,0,0]=4 994 B12R1.374 CCCCc1cc(ccc1F)N 271570a_100020621405_100000760356 [1,0,1,0,0,0|2,0,0]=4 995 B12R1.374 CCCCc1cc(ccc1F)O 271570a_100020621405_100000693481 [1,0,1,0,0,0|2,0,0]=4 996 B12R1.374 CCCCc1cc(ccc1N)Br 271570a_100020621405_100000187925 [1,0,1,0,0,0|1,0,0]=3 997 B12R1.374 CCCCc1cc(ccc1N)C 271570a_100020621405_100000210942 [1,0,1,0,0,0|0,0,0]=2 998 B12R1.374 CCCCc1cc(ccc1N)Cl 271570a_100020621405_100000761889 [1,0,1,0,0,0|1,0,0]=3 999 B12R1.374 CCCCc1cc(ccc1N)F 271570a_100020621405_100000760547 [1,0,1,0,0,0|1,0,0]=3 1000 B12R1.374 CCCCc1cc(ccc1N)N 271570a_100020621405_100011534242 [1,0,1,0,0,0|1,0,0]=3 1001 B12R1.374 CCCCc1cc(ccc1N)O 271570a_100020621405_100012001276 [1,0,1,0,0,0|1,0,0]=3 1002 B12R1.374 CCCCc1cc(ccc1O)Br 271570a_100020621405_100012355227 [1,0,1,0,0,0|2,0,0]=4 1003 B12R1.374 CCCCc1cc(ccc1O)C 271570a_100020621405_100000765521 [1,0,1,0,0,0|1,0,0]=3 1004 B12R1.374 CCCCc1cc(ccc1O)Cl 271570a_100020621405_100011356953 [1,0,1,0,0,0|2,0,0]=4 1005 B12R1.374 CCCCc1cc(ccc1O)F 271570a_100020621405_100000211999 [1,0,1,0,0,0|2,0,0]=4 1006 B12R1.374 CCCCc1cc(ccc1O)N 271570a_100020621405_100011534360 [1,0,1,0,0,0|2,0,0]=4 1007 B12R1.374 CCCCc1cc(ccc1O)O 271570a_100020621405_100009813629 [1,0,1,0,0,0|2,0,0]=4 1008 B12R1.374 CCCCc1cc(cnc1C)C 271570a_100020621405_100009817436 [1,0,1,0,0,0|2,0,0]=4 1009 B12R1.374 CCCCc1cc(cnc1Cl)C 271570a_100020621405_100010210167 [1,0,1,0,0,0|2,0,0]=4 1010 B12R1.374 CCCCc1cc(cnc1F)C 271570a_100020621405_100000049784 [1,0,1,0,0,0|2,0,0]=4 1011 B12R1.374 CCCCc1cc(cnc1N)Br 271570a_100020621405_100000760472 [1,0,1,0,0,0|2,0,0]=4 1012 B12R1.374 CCCCc1cc(cnc1N)C 271570a_100020621405_100000049664 [1,0,1,0,0,0|1,0,0]=3 1013 B12R1.374 CCCCc1cc(cnc1N)Cl 271570a_100020621405_100000050159 [1,0,1,0,0,0|2,0,0]=4 1014 B12R1.374 CCCCc1cc(cnc1N)F 271570a_100020621405_100009814671 [1,0,1,0,0,0|2,0,0]=4 1015 B12R1.374 CCCCc1cc(cnc1N)N 271570a_100020621405_200011934315 [1,0,1,0,0,0|2,0,0]=4 1016 B12R1.374 CCCCc1cc(cnc1O)C 271570a_100020621405_100000049931 [1,0,1,0,0,0|2,0,0]=4 1017 B12R1.374 CCCCc1cc(ncc1C)C 271570a_100020621405_100009862788 [1,0,1,0,0,0|2,0,0]=4 1018 B12R1.374 CCCCc1cc(ncc1F)C 271570a_100020621405_100009867690 [1,0,1,0,0,0|2,0,0]=4 1019 B12R1.374 CCCCc1cc(ncc1N)Cl 271570a_100020621405_100000050123 [1,0,1,0,0,0|2,0,0]=4 1020 B12R1.374 CCCCc1cc(ncc1O)C 271570a_100020621405_100009843476 [1,0,1,0,0,0|2,0,0]=4 1021 B12R1.374 CCCCc1cn(ccc1=O)C 271570a_100020621405_100010750718 [1,0,1,0,0,0|2,0,0]=4 1022 B12R1.374 CCCCc1nc(ccc1C)C 271570a_100020621405_100009854376 [1,0,1,0,0,0|2,0,0]=4 1023 B12R1.374 CCCCc1nc(ccc1F)C 271570a_100020621405_100009817602 [1,0,1,0,0,0|2,0,0]=4 1024 B12R1.374 CCCCc1nc(ccc1N)Br 271570a_100020621405_100010168765 [1,0,1,0,0,0|2,0,0]=4 1025 B12R1.374 CCCCc1nc(ccc1N)C 271570a_100020621405_100000685570 [1,0,1,0,0,0|1,0,0]=3 1026 B12R1.374 CCCCc1nc(ccc1N)Cl 271570a_100020621405_100010233647 [1,0,1,0,0,0|2,0,0]=4 1027 B12R1.374 CCCCc1nc(ccc1N)F 271570a_100020621405_100009879877 [1,0,1,0,0,0|2,0,0]=4 1028 B12R1.374 CCCCc1nc(ccc1N)N 271570a_100020621405_200009884323 [1,0,1,0,0,0|2,0,0]=4 1029 B12R1.374 CCCCc1nc(ccc1O)C 271570a_100020621405_100000702858 [1,0,1,0,0,0|2,0,0]=4 1030 B12R1.374 CCCCc1nc(cnc1N)C 271570a_100020621405_100009819049 [1,0,1,0,0,0|2,0,0]=4 1031 B12R1.374 CCCCc1nc(ncc1N)C 271570a_100020621405_100009873743 [1,0,1,0,0,0|2,0,0]=4 1032 B12R1.374 CCCNc1cc(ccc1Br)C 34a_100000745044_100000210303 [1,0,1,0,0,0|2,0,0]=4 1033 B12R1.374 CCCNc1cc(ccc1C)C 2230a_100000185781_100000210303 [1,0,1,0,0,0|2,0,0]=4 1034 B12R1.374 CCCNc1cc(ccc1C)C 34a_100000185781_100000210303 [1,0,1,0,0,0|2,0,0]=4 1035 B12R1.374 CCCNc1cc(ccc1C)C 7a_100000185781_100000210303 [1,0,1,0,0,0|2,0,0]=4 1036 B12R1.374 CCCNc1cc(ccc1Cl)C 34a_100011215360_100000210303 [1,0,1,0,0,0|2,0,0]=4 1037 B12R1.374 CCCNc1cc(ccc1F)C 34a_100000211285_100000210303 [1,0,1,0,0,0|2,0,0]=4 1038 B12R1.374 CCCNc1cc(ccc1I)C 34a_100011216686_100000210303 [1,0,1,0,0,0|2,0,0]=4 1039 B12R1.374 CCCNc1cc(ccc1O)C 34a_100011215204_100000210303 [1,0,1,0,0,0|2,0,0]=4 1040 B12R1.374 CCCOc1cc(ccc1Br)C 34a_100012002257_100000210303 [1,0,1,0,0,0|2,0,0]=4 1041 B12R1.374 CCCOc1cc(ccc1Br)C 7a_100012002257_100000210303 [1,0,1,0,0,0|2,0,0]=4 1042 B12R1.374 CCCOc1cc(ccc1C)C 34a_100000210931_100000210303 [1,0,1,0,0,0|2,0,0]=4 1043 B12R1.374 CCCOc1cc(ccc1C)C 7a_100000210931_100000210303 [1,0,1,0,0,0|2,0,0]=4 1044 B12R1.374 CCCOc1cc(ccc1Cl)C 34a_100000211493_100000210303 [1,0,1,0,0,0|2,0,0]=4 1045 B12R1.374 CCCOc1cc(ccc1Cl)C 7a_100000211493_100000210303 [1,0,1,0,0,0|2,0,0]=4 1046 B12R1.374 CCCOc1cc(ccc1F)C 34a_100000759540_100000210303 [1,0,1,0,0,0|2,0,0]=4 1047 B12R1.374 CCCOc1cc(ccc1F)C 7a_100000759540_100000210303 [1,0,1,0,0,0|2,0,0]=4 1048 B12R1.374 CCCOc1cc(ccc1N)Br 34a_100000739049_100000210303 [1,0,1,0,0,0|2,0,0]=4 1049 B12R1.374 CCCOc1cc(ccc1N)Br 7a_100000739049_100000210303 [1,0,1,0,0,0|2,0,0]=4 1050 B12R1.374 CCCOc1cc(ccc1N)C 34a_100000211527_100000210303 [1,0,1,0,0,0|1,0,0]=3 1051 B12R1.374 CCCOc1cc(ccc1N)C 7a_100000211527_100000210303 [1,0,1,0,0,0|1,0,0]=3 1052 B12R1.374 CCCOc1cc(ccc1N)Cl 34a_100000185728_100000210303 [1,0,1,0,0,0|2,0,0]=4 1053 B12R1.374 CCCOc1cc(ccc1N)Cl 7a_100000185728_100000210303 [1,0,1,0,0,0|2,0,0]=4 1054 B12R1.374 CCCOc1cc(ccc1N)F 34a_100000753323_100000210303 [1,0,1,0,0,0|2,0,0]=4 1055 B12R1.374 CCCOc1cc(ccc1N)F 7a_100000753323_100000210303 [1,0,1,0,0,0|2,0,0]=4 1056 B12R1.374 CCCOc1cc(ccc1N)I 34a_100000057187_100000210303 [1,0,1,0,0,0|2,0,0]=4 1057 B12R1.374 CCCOc1cc(ccc1N)I 7a_100000057187_100000210303 [1,0,1,0,0,0|2,0,0]=4 1058 B12R1.374 CCCOc1cc(ccc1N)N 34a_100025717382_100000210303 [1,0,1,0,0,0|2,0,0]=4 1059 B12R1.374 CCCOc1nc(ccc1N)C 34a_100000687486_100000210303 [1,0,1,0,0,0|2,0,0]=4 1060 B12R1.374 CCCSc1cc(ccc1Br)C 62a_100000210303_100012353751 [1,0,1,0,0,0|2,0,0]=4 1061 B12R1.374 CCCSc1cc(ccc1Br)C 62a_100012353751_100000210303 [1,0,1,0,0,0|2,0,0]=4 1062 B12R1.374 CCCSc1cc(ccc1C)C 62a_100000210303_100000210833 [1,0,1,0,0,0|2,0,0]=4 1063 B12R1.374 CCCSc1cc(ccc1C)C 62a_100000210833_100000210303 [1,0,1,0,0,0|2,0,0]=4 1064 B12R1.374 CCCSc1cc(ccc1Cl)C 62a_100000210303_100012356289 [1,0,1,0,0,0|2,0,0]=4 1065 B12R1.374 CCCSc1cc(ccc1Cl)C 62a_100012356289_100000210303 [1,0,1,0,0,0|2,0,0]=4 1066 B12R1.374 CCCSc1cc(ccc1F)C 62a_100000210303_100000736223 [1,0,1,0,0,0|2,0,0]=4 1067 B12R1.374 CCCSc1cc(ccc1F)C 62a_100000736223_100000210303 [1,0,1,0,0,0|2,0,0]=4 1068 B12R1.374 CCCSc1cc(ccc1N)Br 62a_100000187925_100000210303 [1,0,1,0,0,0|2,0,0]=4 1069 B12R1.374 CCCSc1cc(ccc1N)Br 62a_100000210303_100000187925 [1,0,1,0,0,0|2,0,0]=4 1070 B12R1.374 CCCSc1cc(ccc1N)C 62a_100000210303_100011356834 [1,0,1,0,0,0|1,0,0]=3 1071 B12R1.374 CCCSc1cc(ccc1N)C 62a_100011356834_100000210303 [1,0,1,0,0,0|1,0,0]=3 1072 B12R1.374 CCCSc1cc(ccc1N)Cl 62a_100000210303_100000761889 [1,0,1,0,0,0|2,0,0]=4 1073 B12R1.374 CCCSc1cc(ccc1N)Cl 62a_100000761889_100000210303 [1,0,1,0,0,0|2,0,0]=4 1074 B12R1.374 CCCSc1cc(ccc1N)F 62a_100000210303_100000760547 [1,0,1,0,0,0|2,0,0]=4 1075 B12R1.374 CCCSc1cc(ccc1N)F 62a_100000760547_100000210303 [1,0,1,0,0,0|2,0,0]=4 1076 B12R1.374 CCCSc1cc(ccc1N)N 62a_100000210303_100011534242 [1,0,1,0,0,0|2,0,0]=4 1077 B12R1.374 CCCSc1cc(ccc1N)N 62a_100011534242_100000210303 [1,0,1,0,0,0|2,0,0]=4 1078 B12R1.374 CCCSc1cc(ccc1N)O 62a_100000210303_100012001276 [1,0,1,0,0,0|2,0,0]=4 1079 B12R1.374 CCCSc1cc(ccc1N)O 62a_100012001276_100000210303 [1,0,1,0,0,0|2,0,0]=4 1080 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000210303_100000765521 [1,0,1,0,0,0|2,0,0]=4 1081 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000765521_100000210303 [1,0,1,0,0,0|2,0,0]=4 1082 B12R1.374 CCCSc1cc(cnc1N)C 62a_100000049664_100000210303 [1,0,1,0,0,0|2,0,0]=4 1083 B12R1.374 CCCSc1cc(cnc1N)C 62a_100000210303_100000049664 [1,0,1,0,0,0|2,0,0]=4 1084 B12R1.374 CCCSc1nc(ccc1N)C 62a_100000210303_100000685570 [1,0,1,0,0,0|2,0,0]=4 1085 B12R1.374 CCCSc1nc(ccc1N)C 62a_100000685570_100000210303 [1,0,1,0,0,0|2,0,0]=4 1086 B12R1.374 CCNCc1cc(ccc1Br)C 207a_100015525214_100011551863 [1,0,1,0,0,0|2,0,0]=4 1087 B12R1.374 CCNCc1cc(ccc1Br)C 270004a_100015525214_100011551863 [1,0,1,0,0,0|2,0,0]=4 1088 B12R1.374 CCNCc1cc(ccc1C)C 207a_100015525214_100000211343 [1,0,1,0,0,0|2,0,0]=4 1089 B12R1.374 CCNCc1cc(ccc1C)C 2230a_100015525214_100000184699 [1,0,1,0,0,0|2,0,0]=4 1090 B12R1.374 CCNCc1cc(ccc1C)C 270004a_100015525214_100000211343 [1,0,1,0,0,0|2,0,0]=4 1091 B12R1.374 CCNCc1cc(ccc1C)C 34a_100000174964_100000210202 [1,0,1,0,0,0|2,0,0]=4 1092 B12R1.374 CCNCc1cc(ccc1Cl)C 207a_100015525214_100011551332 [1,0,1,0,0,0|2,0,0]=4 1093 B12R1.374 CCNCc1cc(ccc1Cl)C 2230a_100015525214_100009871730 [1,0,1,0,0,0|2,0,0]=4 1094 B12R1.374 CCNCc1cc(ccc1Cl)C 2230a_100025705715_100000210202 [1,0,1,0,0,0|2,0,0]=4 1095 B12R1.374 CCNCc1cc(ccc1Cl)C 270004a_100015525214_100011551332 [1,0,1,0,0,0|2,0,0]=4 1096 B12R1.374 CCNCc1cc(ccc1Cl)C 34a_100025705715_100000210202 [1,0,1,0,0,0|2,0,0]=4 1097 B12R1.374 CCNCc1cc(ccc1F)C 207a_100015525214_100000756917 [1,0,1,0,0,0|2,0,0]=4 1098 B12R1.374 CCNCc1cc(ccc1F)C 2230a_100015525214_100011260760 [1,0,1,0,0,0|2,0,0]=4 1099 B12R1.374 CCNCc1cc(ccc1F)C 270004a_100015525214_100000756917 [1,0,1,0,0,0|2,0,0]=4 1100 B12R1.374 CCNCc1cc(ccc1F)C 34a_100102693586_100000210202 [1,0,1,0,0,0|2,0,0]=4 1101 B12R1.374 CCNCc1cc(ccc1I)C 207a_100015525214_100010150105 [1,0,1,0,0,0|2,0,0]=4 1102 B12R1.374 CCNCc1cc(ccc1I)C 270004a_100015525214_100010150105 [1,0,1,0,0,0|2,0,0]=4 1103 B12R1.374 CCOCc1cc(ccc1Br)C 34a_100012361352_100000210202 [1,0,1,0,0,0|2,0,0]=4 1104 B12R1.374 CCOCc1cc(ccc1Br)C 7a_100012361352_100000210202 [1,0,1,0,0,0|2,0,0]=4 1105 B12R1.374 CCOCc1cc(ccc1C)C 34a_100121572206_100000184699 [1,0,1,0,0,0|2,0,0]=4 1106 B12R1.374 CCOCc1cc(ccc1C)C 34a_200011215349_100000210202 [1,0,1,0,0,0|2,0,0]=4 1107 B12R1.374 CCOCc1cc(ccc1C)C 7a_200011215349_100000210202 [1,0,1,0,0,0|2,0,0]=4 1108 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100009878994_100000210202 [1,0,1,0,0,0|2,0,0]=4 1109 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100121572206_100009871730 [1,0,1,0,0,0|2,0,0]=4 1110 B12R1.374 CCOCc1cc(ccc1Cl)C 7a_100009878994_100000210202 [1,0,1,0,0,0|2,0,0]=4 1111 B12R1.374 CCOCc1cc(ccc1F)C 34a_100011692775_100000210202 [1,0,1,0,0,0|2,0,0]=4 1112 B12R1.374 CCOCc1cc(ccc1F)C 34a_100121572206_100011260760 [1,0,1,0,0,0|2,0,0]=4 1113 B12R1.374 CCOCc1cc(ccc1F)C 7a_100011692775_100000210202 [1,0,1,0,0,0|2,0,0]=4 1114 B12R1.374 CCOCc1cc(ccc1N)Br 34a_100012353972_100000210202 [1,0,1,0,0,0|2,0,0]=4 1115 B12R1.374 CCOCc1cc(ccc1N)Br 7a_100012353972_100000210202 [1,0,1,0,0,0|2,0,0]=4 1116 B12R1.374 CCOCc1cc(ccc1N)C 34a_100011215565_100000210202 [1,0,1,0,0,0|1,0,0]=3 1117 B12R1.374 CCOCc1cc(ccc1N)C 7a_100011215565_100000210202 [1,0,1,0,0,0|1,0,0]=3 1118 B12R1.374 CCOCc1cc(ccc1N)Cl 34a_100011214999_100000210202 [1,0,1,0,0,0|2,0,0]=4 1119 B12R1.374 CCOCc1cc(ccc1N)Cl 7a_100011214999_100000210202 [1,0,1,0,0,0|2,0,0]=4 1120 B12R1.374 CCOCc1cc(ccc1N)F 34a_100011296978_100000210202 [1,0,1,0,0,0|2,0,0]=4 1121 B12R1.374 CCOCc1cc(ccc1N)F 7a_100011296978_100000210202 [1,0,1,0,0,0|2,0,0]=4 1122 B12R1.374 CCSCc1cc(ccc1C)C 62a_100000184699_100000210202 [1,0,1,0,0,0|2,0,0]=4 1123 B12R1.374 CCSCc1cc(ccc1C)C 62a_100000210202_100000184699 [1,0,1,0,0,0|2,0,0]=4 1124 B12R1.374 CCSCc1cc(ccc1Cl)C 62a_100000210202_100009871730 [1,0,1,0,0,0|2,0,0]=4 1125 B12R1.374 CCSCc1cc(ccc1Cl)C 62a_100009871730_100000210202 [1,0,1,0,0,0|2,0,0]=4 1126 B12R1.374 CCSCc1cc(ccc1F)C 62a_100000210202_100011260760 [1,0,1,0,0,0|2,0,0]=4 1127 B12R1.374 CCSCc1cc(ccc1F)C 62a_100011260760_100000210202 [1,0,1,0,0,0|2,0,0]=4 1128 B12R1.374 CNCCc1cc(ccc1C)C 2230a_200011485678_200000210301 [1,0,1,0,0,0|2,0,0]=4 1129 B12R1.374 CNCCc1cc(ccc1C)C 34a_200011485678_200000210301 [1,0,1,0,0,0|2,0,0]=4 1130 B12R1.374 COCCc1cc(ccc1C)C 34a_100011694955_200000210301 [1,0,1,0,0,0|2,0,0]=4 1131 B12R1.374 COCCc1cc(ccc1C)C 7a_100011694955_200000210301 [1,0,1,0,0,0|2,0,0]=4 1132 B12R1.374 COCSc1cc(ccc1N)C 62a_100000766300_100011356834 [1,0,1,0,0,0|2,0,0]=4 1133 B12R1.374 COCSc1cc(ccc1N)C 62a_100011356834_100000766300 [1,0,1,0,0,0|2,0,0]=4 1134 B12R1.374 CSCOc1cc(ccc1N)C 34a_100000211527_100011218213 [1,0,1,0,0,0|2,0,0]=4 1135 B12R1.374 CSCSc1cc(ccc1N)C 62a_100011218213_100011356834 [1,0,1,0,0,0|2,0,0]=4 1136 B12R1.374 CSCSc1cc(ccc1N)C 62a_100011356834_100011218213 [1,0,1,0,0,0|2,0,0]=4 1137 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 2230a_200011485678_200025704644 [1,0,1,0,0,0|2,0,0]=4 1138 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 34a_200011485678_200025704644 [1,0,1,0,0,0|2,0,0]=4 1139 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 34a_100011694955_200025704644 [1,0,1,0,0,0|2,0,0]=4 1140 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 7a_100011694955_200025704644 [1,0,1,0,0,0|2,0,0]=4 1141 B12R1.374 Cc1ccc(c(c1)COCF)N 34a_100011215565_100015361967 [1,0,1,0,0,0|2,0,0]=4 1142 B12R1.374 Cc1ccc(c(c1)COCF)N 7a_100011215565_100015361967 [1,0,1,0,0,0|2,0,0]=4 1143 B12R1.374 Cc1ccc(c(c1)OCCF)N 34a_100000211527_100011217306 [1,0,1,0,0,0|2,0,0]=4 1144 B12R1.374 Cc1ccc(c(c1)OCCF)N 7a_100000211527_100011217306 [1,0,1,0,0,0|2,0,0]=4 1145 B12R1.374 Cc1ccc(c(c1)OCCO)N 34a_100000211527_100000211926 [1,0,1,0,0,0|2,0,0]=4 1146 B12R1.374 Cc1ccc(c(c1)OCCO)N 7a_100000211527_100000211926 [1,0,1,0,0,0|2,0,0]=4 1147 B12R1.374 Cc1ccc(c(c1)SCCF)N 62a_100011217306_100011356834 [1,0,1,0,0,0|2,0,0]=4 1148 B12R1.374 Cc1ccc(c(c1)SCCF)N 62a_100011356834_100011217306 [1,0,1,0,0,0|2,0,0]=4 1149 B12R1.374 Cc1ccc(c(c1)SCCO)N 62a_100000211926_100011356834 [1,0,1,0,0,0|2,0,0]=4 1150 B12R1.374 Cc1ccc(c(c1)SCCO)N 62a_100011356834_100000211926 [1,0,1,0,0,0|2,0,0]=4 1151 B12R1.46 C=C(C)c1cc(ccc1NC)C 271570a_100000694244_100000221369 [1,0,1,0,0,0|1,0,1]=4 1152 B12R1.46 CC(C)c1cc(ccc1N[13CH3])Br 2230a_100000694223_200025704644 [1,0,1,0,0,0|2,0,0]=4 1153 B12R1.46 CC(C)c1cc(ccc1N[13CH3])Br 34a_100000694223_200025704644 [1,0,1,0,0,0|2,0,0]=4 1154 B12R1.46 CC(C)c1cc(ccc1N[13CH3])Br 7a_100000694223_200025704644 [1,0,1,0,0,0|2,0,0]=4 1155 B12R1.46 CC(C)c1cc(ccc1N[13CH3])F 2230a_100011941472_200025704644 [1,0,1,0,0,0|2,0,0]=4 1156 B12R1.46 CC(C)c1cc(ccc1N[13CH3])F 34a_100011941472_200025704644 [1,0,1,0,0,0|2,0,0]=4 1157 B12R1.46 CC(C)c1cc(ccc1N[13CH3])F 7a_100011941472_200025704644 [1,0,1,0,0,0|2,0,0]=4 1158 B12R1.46 CC(O)c1cc(ccc1O[13CH3])F 34a_200011305312_200025704644 [1,0,1,0,0,0|2,0,0]=4 1159 B12R1.46 CC(O)c1cc(ccc1O[13CH3])F 7a_200011305312_200025704644 [1,0,1,0,0,0|2,0,0]=4 1160 B12R1.46 CNc1ccc(cc1C(C)C)Br 2230a_100000694223_200000210301 [1,0,1,0,0,0|2,0,0]=4 1161 B12R1.46 CNc1ccc(cc1C(C)C)Br 34a_100000694223_200000210301 [1,0,1,0,0,0|2,0,0]=4 1162 B12R1.46 CNc1ccc(cc1C(C)C)Br 7a_100000694223_200000210301 [1,0,1,0,0,0|2,0,0]=4 1163 B12R1.46 CNc1ccc(cc1C(C)C)F 2230a_100011941472_200000210301 [1,0,1,0,0,0|2,0,0]=4 1164 B12R1.46 CNc1ccc(cc1C(C)C)F 34a_100011941472_200000210301 [1,0,1,0,0,0|2,0,0]=4 1165 B12R1.46 CNc1ccc(cc1C(C)C)F 7a_100011941472_200000210301 [1,0,1,0,0,0|2,0,0]=4 1166 B12R1.46 COc1ccc(cc1C(C)O)F 34a_200011305312_200000210301 [1,0,1,0,0,0|2,0,0]=4 1167 B12R1.46 COc1ccc(cc1C(C)O)F 7a_200011305312_200000210301 [1,0,1,0,0,0|2,0,0]=4 1168 B12R1.46 CSc1ccc(cc1[C@H](C)O)F 62a_100134768474_200000210301 [1,0,1,0,0,0|2,0,0]=4 1169 B12R1.46 CSc1ccc(cc1[C@H](C)O)F 62a_200000210301_100134768474 [1,0,1,0,0,0|2,0,0]=4 1170 B12R1.46 C[C@H](O)c1cc(ccc1S[13CH3])F 62a_100134768474_200025704644 [1,0,1,0,0,0|2,0,0]=4 1171 B12R1.46 C[C@H](O)c1cc(ccc1S[13CH3])F 62a_200025704644_100134768474 [1,0,1,0,0,0|2,0,0]=4 1172 B12R1.283 C=C(C)c1ccccc1NCC 271570a_100000694244_114873767003 [1,0,1,0,0,0|1,0,1]=4 1173 B12R1.283 C=C(C)c1ccccc1NCC 34a_100000037685_100000210202 [1,0,1,0,0,0|1,0,1]=4 1174 B12R1.283 CC(C)c1ccccc1NCF 34a_100000210643_100015361967 [1,0,1,0,0,0|2,0,0]=4 1175 B12R1.283 CC(C)c1ccccc1NCF 7a_100000210643_100015361967 [1,0,1,0,0,0|2,0,0]=4 1176 B12R1.283 CC(O)c1ccccc1OCF 34a_200011232679_100015361967 [1,0,1,0,0,0|2,0,0]=4 1177 B12R1.283 CC(O)c1ccccc1OCF 7a_200011232679_100015361967 [1,0,1,0,0,0|2,0,0]=4 1178 B12R1.283 CC(O)c1ccccc1SCF 62a_100000702211_100015361967 [1,0,1,0,0,0|2,0,0]=4 1179 B12R1.283 CC(O)c1ccccc1SCF 62a_100015361967_100000702211 [1,0,1,0,0,0|2,0,0]=4 1180 B12R1.283 CC=Cc1ccccc1C(C)O 271570a_100016259895_100000702211 [1,0,1,0,0,0|1,0,1]=4 1181 B12R1.283 CCNc1ccccc1C(C)C 2230a_100000210643_100000210202 [1,0,1,0,0,0|1,0,0]=3 1182 B12R1.283 CCNc1ccccc1C(C)C 34a_100000210643_100000210202 [1,0,1,0,0,0|1,0,0]=3 1183 B12R1.283 CCNc1ccccc1C(C)C 7a_100000210643_100000210202 [1,0,1,0,0,0|1,0,0]=3 1184 B12R1.283 CCNc1ccccc1C(C)O 2230a_100011405641_100000210202 [1,0,1,0,0,0|0,0,0]=2 1185 B12R1.283 CCNc1ccccc1C(F)F 2230a_100000734540_100000210202 [1,0,1,0,0,0|2,0,0]=4 1186 B12R1.283 CCNc1ccccc1C(F)F 34a_100000734540_100000210202 [1,0,1,0,0,0|2,0,0]=4 1187 B12R1.283 CCNc1ccccc1C(F)F 7a_100000734540_100000210202 [1,0,1,0,0,0|2,0,0]=4 1188 B12R1.283 CCOc1ccccc1C(C)C 34a_100000211617_100000210202 [1,0,1,0,0,0|2,0,0]=4 1189 B12R1.283 CCOc1ccccc1C(C)C 7a_100000211617_100000210202 [1,0,1,0,0,0|2,0,0]=4 1190 B12R1.283 CCOc1ccccc1C(C)O 34a_200011232679_100000210202 [1,0,1,0,0,0|1,0,0]=3 1191 B12R1.283 CCOc1ccccc1C(C)O 7a_200011232679_100000210202 [1,0,1,0,0,0|1,0,0]=3 1192 B12R1.283 CCOc1ccccc1[C@@H](C)N 34a_100025703389_100000210202 [1,0,1,0,0,0|2,0,0]=4 1193 B12R1.283 CCSc1ccccc1C(C)C 62a_100000210202_100000708600 [1,0,1,0,0,0|2,0,0]=4 1194 B12R1.283 CCSc1ccccc1C(C)C 62a_100000708600_100000210202 [1,0,1,0,0,0|2,0,0]=4 1195 B12R1.283 CCSc1ccccc1C(C)N 62a_100000181357_100000210202 [1,0,1,0,0,0|2,0,0]=4 1196 B12R1.283 CCSc1ccccc1C(C)N 62a_100000210202_100000181357 [1,0,1,0,0,0|2,0,0]=4 1197 B12R1.283 CCSc1ccccc1C(C)O 62a_100000210202_100000702211 [1,0,1,0,0,0|1,0,0]=3 1198 B12R1.283 CCSc1ccccc1C(C)O 62a_100000702211_100000210202 [1,0,1,0,0,0|1,0,0]=3 1199 B12R1.283 CCSc1cccnc1[C@H](C)O 62a_100000210202_100013325542 [1,0,1,0,0,0|2,0,0]=4 1200 B12R1.283 CCSc1cccnc1[C@H](C)O 62a_100013325542_100000210202 [1,0,1,0,0,0|2,0,0]=4 1201 B12R1.283 CCSc1ncccc1C(C)O 62a_100000210202_100009865335 [1,0,1,0,0,0|2,0,0]=4 1202 B12R1.283 CCSc1ncccc1C(C)O 62a_100009865335_100000210202 [1,0,1,0,0,0|2,0,0]=4 1203 B12R1.17 CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210303 [1,0,1,0,0,0|0,0,2]=4 1204 B12R1.17 CCCN(C)c1cccc(c1)C 2230a_100000219674_100000210303 [1,0,1,0,0,0|2,0,0]=4 1205 B12R1.17 CCCN(C)c1cccc(c1)C 269982a_100000219674_100000210303 [1,0,1,0,0,0|2,0,0]=4 1206 B12R1.17 CCCN(C)c1cccc(c1)C 34a_100000219674_100000210303 [1,0,1,0,0,0|2,0,0]=4 1207 B12R1.17 CCNC(C)c1cccc(c1)C 269862a_100015525214_100000211476 [1,0,1,0,0,0|2,0,0]=4 1208 B12R1.17 CCN[C@H](C)c1cccc(c1)C 2230a_100000698126_100000210202 [1,0,1,0,0,0|2,0,0]=4 1209 B12R1.17 CCN[C@H](C)c1cccc(c1)C 34a_100000698126_100000210202 [1,0,1,0,0,0|2,0,0]=4 1210 B12R1.17 CCOC(C)c1cccc(c1)C 34a_100000757818_100000210202 [1,0,1,0,0,0|2,0,0]=4 1211 B12R1.17 CCOC(C)c1cccc(c1)C 7a_100000757818_100000210202 [1,0,1,0,0,0|2,0,0]=4 1212 B12R1.17 CNCC(O)c1cccc(c1)O 2230a_100020657549_200000210301 [1,0,1,0,0,0|2,0,0]=4 1213 B12R1.17 CNCC(O)c1cccc(c1)O 271570a_203496583355_200000733937 [1,0,1,0,0,0|2,0,0]=4 1214 B12R1.17 CNCC(O)c1cccc(c1)O 34a_100020657549_200000210301 [1,0,1,0,0,0|2,0,0]=4 1215 B12R1.17 COC[C@@H](N)c1cccc(c1)C 34a_100009818812_200000210301 [1,0,1,0,0,0|2,0,0]=4 1216 B12R1.17 Cc1cccc(c1)[C@H](N)CO[13CH3] 34a_100009818812_200025704644 [1,0,1,0,0,0|2,0,0]=4 1217 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 2230a_100020657549_200025704644 [1,0,1,0,0,0|2,0,0]=4 1218 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 34a_100020657549_200025704644 [1,0,1,0,0,0|2,0,0]=4 1219 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,0,1,0,0,0|1,0,1]=4 1220 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,0,1,0,0,0|1,0,1]=4 1221 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,0,1,0,0,0|1,0,1]=4 1222 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [1,0,1,0,0,0|2,0,0]=4 1223 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [1,0,1,0,0,0|2,0,0]=4 1224 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [1,0,1,0,0,0|2,0,0]=4 1225 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [1,0,1,0,0,0|2,0,0]=4 1226 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [1,0,1,0,0,0|2,0,0]=4 1227 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [1,0,1,0,0,0|2,0,0]=4 1228 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [1,0,1,0,0,0|2,0,0]=4 1229 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,0,1,0,0,0|1,0,1]=4 1230 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [1,0,1,0,0,0|1,0,1]=4 1231 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [1,0,1,0,0,0|1,0,1]=4 1232 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [1,0,1,0,0,0|1,0,1]=4 1233 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_100102631434_100011713685 [1,0,1,0,0,0|2,0,0]=4 1234 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_114849113767_200000210301 [1,0,1,0,0,0|2,0,0]=4 1235 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_100102631434_100011713685 [1,0,1,0,0,0|2,0,0]=4 1236 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_114849113767_200000210301 [1,0,1,0,0,0|2,0,0]=4 1237 B12R1.226 Cc1cccc(c1)CCN(C)C 34a_114849113767_200000210301 [1,0,1,0,0,0|2,0,0]=4 1238 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 2230a_114849113767_200025704644 [1,0,1,0,0,0|2,0,0]=4 1239 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 269982a_114849113767_200025704644 [1,0,1,0,0,0|2,0,0]=4 1240 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 34a_114849113767_200025704644 [1,0,1,0,0,0|2,0,0]=4 1241 B12R1.226 Cc1cccc(c1)CNC(C)C 207a_100138425928_100000211157 [1,0,1,0,0,0|2,0,0]=4 1242 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100000185548_100000210206 [1,0,1,0,0,0|2,0,0]=4 1243 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100138425928_100000211840 [1,0,1,0,0,0|2,0,0]=4 1244 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100000185548_100000210206 [1,0,1,0,0,0|2,0,0]=4 1245 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100138425928_100000211840 [1,0,1,0,0,0|2,0,0]=4 1246 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100000212225_100000211840 [1,0,1,0,0,0|2,0,0]=4 1247 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100011217746_100000210206 [1,0,1,0,0,0|2,0,0]=4 1248 B12R1.226 Cc1cccc(c1)COC(C)C 7a_100011217746_100000210206 [1,0,1,0,0,0|2,0,0]=4 1249 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000210206_100000211840 [1,0,1,0,0,0|2,0,0]=4 1250 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000211840_100000210206 [1,0,1,0,0,0|2,0,0]=4 1251 B12R1.226 Cc1cccc(c1)NCC(C)C 2230a_100000188690_100000210760 [1,0,1,0,0,0|2,0,0]=4 1252 B12R1.226 Cc1cccc(c1)NCC(C)C 34a_100000188690_100000210624 [1,0,1,0,0,0|2,0,0]=4 1253 B12R1.226 Cc1cccc(c1)NCC(C)O 2230a_100000188690_100011218427 [1,0,1,0,0,0|2,0,0]=4 1254 B12R1.226 Cc1cccc(c1)NCC(C)O 34a_100000188690_100011218427 [1,0,1,0,0,0|2,0,0]=4 1255 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 2230a_100000188690_100009817552 [1,0,1,0,0,0|2,0,0]=4 1256 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 34a_100000188690_100009817552 [1,0,1,0,0,0|2,0,0]=4 1257 B12R1.226 Cc1cccc(c1)OCC(C)C 34a_100000210337_100000210624 [1,0,1,0,0,0|2,0,0]=4 1258 B12R1.226 Cc1cccc(c1)OCC(C)C 7a_100000210337_100000210760 [1,0,1,0,0,0|2,0,0]=4 1259 B12R1.226 Cc1cccc(c1)OCC(C)O 34a_100000210337_100011218427 [1,0,1,0,0,0|2,0,0]=4 1260 B12R1.226 Cc1cccc(c1)OCC(C)O 7a_100000210337_100011218427 [1,0,1,0,0,0|2,0,0]=4 1261 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 34a_100000210337_100009817552 [1,0,1,0,0,0|2,0,0]=4 1262 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 7a_100000210337_100009817552 [1,0,1,0,0,0|2,0,0]=4 1263 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100000210624_100011215228 [1,0,1,0,0,0|2,0,0]=4 1264 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100011215228_100000210760 [1,0,1,0,0,0|2,0,0]=4 1265 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011215228_100011218427 [1,0,1,0,0,0|2,0,0]=4 1266 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011218427_100011215228 [1,0,1,0,0,0|2,0,0]=4 1267 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011215228 [1,0,1,0,0,0|2,0,0]=4 1268 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100011215228_100009817552 [1,0,1,0,0,0|2,0,0]=4 1269 B12R1.308 CCOC(C)c1ccccc1N 7a_100011405641_100000210202 [1,0,1,0,0,0|2,0,0]=4 1270 B12R1.308 CNCC(O)c1ccccc1Br 2230a_100011236429_200000210301 [1,0,1,0,0,0|2,0,0]=4 1271 B12R1.308 CNCC(O)c1ccccc1Cl 2230a_200000759403_200000210301 [1,0,1,0,0,0|2,0,0]=4 1272 B12R1.308 CNCC(O)c1ccccc1Cl 34a_200000759403_200000210301 [1,0,1,0,0,0|2,0,0]=4 1273 B12R1.308 [13CH3]NCC(O)c1ccccc1Br 2230a_100011236429_200025704644 [1,0,1,0,0,0|2,0,0]=4 1274 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 2230a_200000759403_200025704644 [1,0,1,0,0,0|2,0,0]=4 1275 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 34a_200000759403_200025704644 [1,0,1,0,0,0|2,0,0]=4 1276 B12R2.24 CN1CCc2ccccc2C1 2230a_100000188457_200000210301 [2,0,0,0,0,0|2,0,0]=4 1277 B12R2.24 CN1CCc2ccccc2C1 269982a_100000188457_200000210301 [2,0,0,0,0,0|2,0,0]=4 1278 B12R2.24 CN1CCc2ccccc2C1 34a_100000188457_200000210301 [2,0,0,0,0,0|2,0,0]=4 1279 B12R2.24 Oc1ccc2c(c1)CCCC2 271570a_203496583355_100011221367 [2,0,0,0,0,0|2,0,0]=4 1280 B12R2.24 Oc1ccc2c(c1)CCCN2 271570a_203496583355_100016994925 [2,0,0,0,0,0|1,0,0]=3 1281 B12R2.24 Oc1ccc2c(c1)CCCO2 271570a_203496583355_100011393166 [2,0,0,0,0,0|2,0,0]=4 1282 B12R2.24 Oc1ccc2c(c1)OCCN2 271570a_203496583355_100012355470 [2,0,0,0,0,0|2,0,0]=4 1283 B12R2.24 Oc1ccc2c(n1)CCCN2 271570a_203496583355_100010277722 [2,0,0,0,0,0|2,0,0]=4 1284 B12R2.24 [13CH3]N1CCc2ccccc2C1 2230a_100000188457_200025704644 [2,0,0,0,0,0|2,0,0]=4 1285 B12R2.24 [13CH3]N1CCc2ccccc2C1 269982a_100000188457_200025704644 [2,0,0,0,0,0|2,0,0]=4 1286 B12R2.24 [13CH3]N1CCc2ccccc2C1 34a_100000188457_200025704644 [2,0,0,0,0,0|2,0,0]=4 1287 B14R1.33 CC(Cc1ccc(cc1)Br)NCCO 270004a_100000210304_100000691760 [0,1,1,0,0,0|2,0,0]=4 1288 B14R1.33 CC(Cc1ccc(cc1)Cl)NCCO 270004a_100000210304_100000747806 [0,1,1,0,0,0|2,0,0]=4 1289 B14R1.33 CC(Cc1ccc(cc1)F)NCCO 270004a_100000210304_100000745281 [0,1,1,0,0,0|2,0,0]=4 1290 B14R1.33 CC(Cc1ccc(cc1)F)OCCO 34a_100011351027_100000211926 [0,1,1,0,0,0|2,0,0]=4 1291 B14R1.33 CC(Cc1ccc(cc1)F)OCCO 7a_100011351027_100000211926 [0,1,1,0,0,0|2,0,0]=4 1292 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 2230a_100102634573_100000211926 [0,1,1,0,0,0|2,0,0]=4 1293 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 270004a_100000210304_100011218180 [0,1,1,0,0,0|2,0,0]=4 1294 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 34a_100102634573_100000211926 [0,1,1,0,0,0|2,0,0]=4 1295 B14R1.33 CCCCC(C)Nc1ccc(cc1)Br 2230a_100000210018_200011215066 [0,1,1,0,0,0|2,0,0]=4 1296 B14R1.33 CCCCC(C)Nc1ccc(cc1)Br 34a_100000210018_200011215066 [0,1,1,0,0,0|2,0,0]=4 1297 B14R1.33 CCCCC(C)Nc1ccc(cc1)C 34a_100000124888_200011215066 [0,1,1,0,0,0|1,0,0]=3 1298 B14R1.33 CCCCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_200011215066 [0,1,1,0,0,0|2,0,0]=4 1299 B14R1.33 CCCCC(C)Nc1ccc(cc1)Cl 34a_100000210052_200011215066 [0,1,1,0,0,0|2,0,0]=4 1300 B14R1.33 CCCCC(C)Nc1ccc(cc1)F 34a_100000185862_200011215066 [0,1,1,0,0,0|2,0,0]=4 1301 B14R1.33 CCCCC(C)Nc1ccc(cc1)I 34a_100000185761_200011215066 [0,1,1,0,0,0|2,0,0]=4 1302 B14R1.33 CCCCC(C)Nc1ccc(cc1)O 34a_100000185829_200011215066 [0,1,1,0,0,0|2,0,0]=4 1303 B14R1.33 CCCCC(C)Oc1ccc(cc1)C 34a_100000210336_200011215066 [0,1,1,0,0,0|2,0,0]=4 1304 B14R1.33 CCCCC(C)Oc1ccc(cc1)C 7a_100000210336_200011215066 [0,1,1,0,0,0|2,0,0]=4 1305 B14R1.33 CCCCC(C)Sc1ccc(cc1)C 62a_100000186775_200011215066 [0,1,1,0,0,0|2,0,0]=4 1306 B14R1.33 CCCCC(C)Sc1ccc(cc1)C 62a_200011215066_100000186775 [0,1,1,0,0,0|2,0,0]=4 1307 B14R1.33 CCCNC(C)Cc1ccc(cc1)C 270004a_100020643023_100000751045 [0,1,1,0,0,0|2,0,0]=4 1308 B14R1.33 CCNCC(C)Oc1ccc(cc1)C 2230a_100000763606_100000210202 [0,1,1,0,0,0|2,0,0]=4 1309 B14R1.33 CCNCC(C)Oc1ccc(cc1)C 34a_100000763606_100000210202 [0,1,1,0,0,0|2,0,0]=4 1310 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000749529 [0,1,1,0,0,0|1,0,1]=4 1311 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000749529 [0,1,1,0,0,0|1,0,1]=4 1312 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000749529 [0,1,1,0,0,0|1,0,1]=4 1313 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 34a_100138415774_200000187088 [0,1,1,0,0,0|1,0,1]=4 1314 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 34a_200009859269_200000210301 [0,1,1,0,0,0|1,0,1]=4 1315 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000749529 [0,1,1,0,0,0|1,0,1]=4 1316 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 7a_200009859269_200000210301 [0,1,1,0,0,0|1,0,1]=4 1317 B14R1.33 COCCN(C)Cc1ccc(cc1)C 2230a_100000743101_100000210814 [0,1,1,0,0,0|2,0,0]=4 1318 B14R1.33 COCCN(C)Cc1ccc(cc1)C 2230a_100000744650_100011201679 [0,1,1,0,0,0|2,0,0]=4 1319 B14R1.33 COCCN(C)Cc1ccc(cc1)C 269982a_100000743101_100000210814 [0,1,1,0,0,0|2,0,0]=4 1320 B14R1.33 COCCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000233755 [0,1,1,0,0,0|2,0,0]=4 1321 B14R1.33 COCCN(C)Cc1ccc(cc1)C 26a_100000743101_200020625495 [0,1,1,0,0,0|2,0,0]=4 1322 B14R1.33 COCCN(C)Cc1ccc(cc1)C 270004a_100000743101_100000211033 [0,1,1,0,0,0|2,0,0]=4 1323 B14R1.33 COCCN(C)Cc1ccc(cc1)C 34a_100000744650_100011201679 [0,1,1,0,0,0|2,0,0]=4 1324 B14R1.33 Cc1ccc(cc1)CC(C)NCCO 270004a_100000210304_100000751045 [0,1,1,0,0,0|1,0,0]=3 1325 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 2230a_100000213112_100000210814 [0,1,1,0,0,0|2,0,0]=4 1326 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 2230a_100000744650_100000230001 [0,1,1,0,0,0|2,0,0]=4 1327 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 2230a_100015185078_200000210301 [0,1,1,0,0,0|2,0,0]=4 1328 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 269982a_100000213112_100000210814 [0,1,1,0,0,0|2,0,0]=4 1329 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 269982a_100000744650_100011215043 [0,1,1,0,0,0|2,0,0]=4 1330 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 269982a_100015185078_200000210301 [0,1,1,0,0,0|2,0,0]=4 1331 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 26a_100000213112_200020625495 [0,1,1,0,0,0|2,0,0]=4 1332 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 270004a_100000213112_100000211033 [0,1,1,0,0,0|2,0,0]=4 1333 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 34a_100000744650_100000230001 [0,1,1,0,0,0|2,0,0]=4 1334 B14R1.33 Cc1ccc(cc1)CN(C)CCCO 34a_100015185078_200000210301 [0,1,1,0,0,0|2,0,0]=4 1335 B14R1.33 Cc1ccc(cc1)CN([13CH3])CCCO 2230a_100015185078_200025704644 [0,1,1,0,0,0|2,0,0]=4 1336 B14R1.33 Cc1ccc(cc1)CN([13CH3])CCCO 269982a_100015185078_200025704644 [0,1,1,0,0,0|2,0,0]=4 1337 B14R1.33 Cc1ccc(cc1)CN([13CH3])CCCO 34a_100015185078_200025704644 [0,1,1,0,0,0|2,0,0]=4 1338 B14R1.33 Cc1ccc(cc1)NC(=O)CCO[13CH3] 34a_200009859269_200025704644 [0,1,1,0,0,0|1,0,1]=4 1339 B14R1.33 Cc1ccc(cc1)NC(=O)CCO[13CH3] 7a_200009859269_200025704644 [0,1,1,0,0,0|1,0,1]=4 1340 B14R1.33 Cc1ccc(cc1)NC(=O)NCCO 2430a_100000124888_100000210304 [0,1,1,0,0,0|1,0,1]=4 1341 B14R1.33 Cc1ccc(cc1)OC(C)CNCF 34a_100000763606_100015361967 [0,1,1,0,0,0|2,0,0]=4 1342 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)Br 1458a_100000185839_100009893172 [0,1,1,0,0,0|2,0,0]=4 1343 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100009893172 [0,1,1,0,0,0|2,0,0]=4 1344 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)F 1458a_100000187176_100009893172 [0,1,1,0,0,0|2,0,0]=4 1345 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)I 1458a_100000187904_100009893172 [0,1,1,0,0,0|2,0,0]=4 1346 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)O 1458a_100000212099_100009893172 [0,1,1,0,0,0|2,0,0]=4 1347 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Br 2230a_100000219623_100009893172 [0,1,1,0,0,0|1,0,0]=3 1348 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Br 269982a_100000219623_100009893172 [0,1,1,0,0,0|1,0,0]=3 1349 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Br 34a_100000219623_100009893172 [0,1,1,0,0,0|1,0,0]=3 1350 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 2230a_100020629279_100009893172 [0,1,1,0,0,0|1,0,0]=3 1351 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 269982a_100020629279_100009893172 [0,1,1,0,0,0|1,0,0]=3 1352 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 34a_100020629279_100009893172 [0,1,1,0,0,0|1,0,0]=3 1353 B14R1.35 CC(CCO)N(C)c1ccc(cc1)F 2230a_100000219829_100009893172 [0,1,1,0,0,0|1,0,0]=3 1354 B14R1.35 CC(CCO)N(C)c1ccc(cc1)F 269982a_100000219829_100009893172 [0,1,1,0,0,0|1,0,0]=3 1355 B14R1.35 CC(CCO)N(C)c1ccc(cc1)F 34a_100000219829_100009893172 [0,1,1,0,0,0|1,0,0]=3 1356 B14R1.35 CC(CCO)N(C)c1ccc(cc1)I 2230a_100000743151_100009893172 [0,1,1,0,0,0|1,0,0]=3 1357 B14R1.35 CC(CCO)N(C)c1ccc(cc1)I 269982a_100000743151_100009893172 [0,1,1,0,0,0|1,0,0]=3 1358 B14R1.35 CC(CCO)N(C)c1ccc(cc1)I 34a_100000743151_100009893172 [0,1,1,0,0,0|1,0,0]=3 1359 B14R1.35 CC(CCO)N(C)c1ccc(cc1)O 269982a_100000182112_100009893172 [0,1,1,0,0,0|1,0,0]=3 1360 B14R1.35 CC(CCO)N(C)c1ccc(cc1)O 34a_100000182112_100009893172 [0,1,1,0,0,0|1,0,0]=3 1361 B14R1.35 CC(CCO)N(C)c1ccc(cn1)Br 27a_100000731037_100000686858 [0,1,1,0,0,0|2,0,0]=4 1362 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)C 1458a_100000188618_100000766640 [0,1,1,0,0,0|2,0,0]=4 1363 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Br 2230a_100000219623_100000766640 [0,1,1,0,0,0|2,0,0]=4 1364 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Br 269982a_100000219623_100000766640 [0,1,1,0,0,0|2,0,0]=4 1365 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Br 34a_100000219623_100000766640 [0,1,1,0,0,0|2,0,0]=4 1366 B14R1.35 CCCC(C)N(C)c1ccc(cc1)C 2230a_100000219977_100000766640 [0,1,1,0,0,0|1,0,0]=3 1367 B14R1.35 CCCC(C)N(C)c1ccc(cc1)C 269982a_100000219977_100000766640 [0,1,1,0,0,0|1,0,0]=3 1368 B14R1.35 CCCC(C)N(C)c1ccc(cc1)C 34a_100000219977_100000766640 [0,1,1,0,0,0|1,0,0]=3 1369 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Cl 2230a_100020629279_100000766640 [0,1,1,0,0,0|2,0,0]=4 1370 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Cl 269982a_100020629279_100000766640 [0,1,1,0,0,0|2,0,0]=4 1371 B14R1.35 CCCC(C)N(C)c1ccc(cc1)Cl 34a_100020629279_100000766640 [0,1,1,0,0,0|2,0,0]=4 1372 B14R1.35 CCCC(C)N(C)c1ccc(cc1)F 2230a_100000219829_100000766640 [0,1,1,0,0,0|2,0,0]=4 1373 B14R1.35 CCCC(C)N(C)c1ccc(cc1)F 269982a_100000219829_100000766640 [0,1,1,0,0,0|2,0,0]=4 1374 B14R1.35 CCCC(C)N(C)c1ccc(cc1)F 34a_100000219829_100000766640 [0,1,1,0,0,0|2,0,0]=4 1375 B14R1.35 CCCC(C)N(C)c1ccc(cc1)I 2230a_100000743151_100000766640 [0,1,1,0,0,0|2,0,0]=4 1376 B14R1.35 CCCC(C)N(C)c1ccc(cc1)I 269982a_100000743151_100000766640 [0,1,1,0,0,0|2,0,0]=4 1377 B14R1.35 CCCC(C)N(C)c1ccc(cc1)I 34a_100000743151_100000766640 [0,1,1,0,0,0|2,0,0]=4 1378 B14R1.35 CCCC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000766640 [0,1,1,0,0,0|2,0,0]=4 1379 B14R1.35 CCCC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000766640 [0,1,1,0,0,0|2,0,0]=4 1380 B14R1.35 COCC(C)N(C)c1ccc(cc1)C 2230a_100000219977_100000765312 [0,1,1,0,0,0|2,0,0]=4 1381 B14R1.35 COCC(C)N(C)c1ccc(cc1)C 269982a_100000219977_100000765312 [0,1,1,0,0,0|2,0,0]=4 1382 B14R1.35 COCC(C)N(C)c1ccc(cc1)C 34a_100000219977_100000765312 [0,1,1,0,0,0|2,0,0]=4 1383 B14R1.35 Cc1ccc(cc1)C(=O)C(C)CCO 1458a_100000188618_100009893172 [0,1,1,0,0,0|1,0,0]=3 1384 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000188618 [0,1,1,0,0,0|2,0,0]=4 1385 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000188618 [0,1,1,0,0,0|2,0,0]=4 1386 B14R1.35 Cc1ccc(cc1)C(C)N(C)CCO 2230a_100000210263_100011261388 [0,1,1,0,0,0|2,0,0]=4 1387 B14R1.35 Cc1ccc(cc1)C(C)N(C)CCO 269982a_100000210263_100011261388 [0,1,1,0,0,0|2,0,0]=4 1388 B14R1.35 Cc1ccc(cc1)N(C)C(=O)CCO 22a_100000219977_100011216618 [0,1,1,0,0,0|1,0,1]=4 1389 B14R1.35 Cc1ccc(cc1)N(C)C(C)CC#N 2230a_100000219977_100009813641 [0,1,1,0,0,0|1,0,1]=4 1390 B14R1.35 Cc1ccc(cc1)N(C)C(C)CC#N 269982a_100000219977_100009813641 [0,1,1,0,0,0|1,0,1]=4 1391 B14R1.35 Cc1ccc(cc1)N(C)C(C)CCO 2230a_100000219977_100009893172 [0,1,1,0,0,0|0,0,0]=2 1392 B14R1.35 Cc1ccc(cc1)N(C)C(C)CCO 269982a_100000219977_100009893172 [0,1,1,0,0,0|0,0,0]=2 1393 B14R1.35 Cc1ccc(cc1)N(C)C(C)CCO 34a_100000219977_100009893172 [0,1,1,0,0,0|0,0,0]=2 1394 B14R1.35 Cc1ccc(nn1)N(C)C(C)CCO 27a_100000731037_100000744512 [0,1,1,0,0,0|2,0,0]=4 1395 B14R1.35 Cc1cnc(cn1)N(C)C(C)CCO 27a_100000731037_100000074397 [0,1,1,0,0,0|2,0,0]=4 1396 B14R1.35 Cc1cnc(nc1)N(C)C(C)CCO 27a_100000731037_100000061069 [0,1,1,0,0,0|2,0,0]=4 1397 B14R1.72 CCCC(CC)Oc1ccc(cc1)C 7a_100000210336_100011219200 [0,1,1,0,0,0|2,0,0]=4 1398 B14R1.72 CCCC(CC)Sc1ccc(cc1)C 62a_100000186775_100011219200 [0,1,1,0,0,0|2,0,0]=4 1399 B14R1.72 CCCC(CC)Sc1ccc(cc1)C 62a_100011219200_100000186775 [0,1,1,0,0,0|2,0,0]=4 1400 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 2230a_100000180869_100000211926 [0,1,1,0,0,0|2,0,0]=4 1401 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 2230a_100000186992_100000210202 [0,1,1,0,0,0|2,0,0]=4 1402 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 2230a_100000210973_100000210814 [0,1,1,0,0,0|2,0,0]=4 1403 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 269982a_100000180869_100000211926 [0,1,1,0,0,0|2,0,0]=4 1404 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 269982a_100000186992_100000204670 [0,1,1,0,0,0|2,0,0]=4 1405 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 269982a_100000210973_100000210814 [0,1,1,0,0,0|2,0,0]=4 1406 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 26a_100000210973_200020625495 [0,1,1,0,0,0|2,0,0]=4 1407 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 270004a_100000210973_100000211033 [0,1,1,0,0,0|2,0,0]=4 1408 B14R1.72 CCN(CCO)Cc1ccc(cc1)C 34a_100000186992_100000210202 [0,1,1,0,0,0|2,0,0]=4 1409 B14R1.72 Cc1ccc(cc1)CN(CF)CCO 269982a_100000186992_100015361967 [0,1,1,0,0,0|2,0,0]=4 1410 B14R1.72 Cc1ccc(cc1)CN(CF)CCO 34a_100000186992_100015361967 [0,1,1,0,0,0|2,0,0]=4 1411 B14R1.134 Cc1ccc(cc1)CN(C)C(C)CO 2230a_100000693034_100000210814 [0,1,1,0,0,0|2,0,0]=4 1412 B14R1.134 Cc1ccc(cc1)CN(C)C(C)CO 2230a_100000744650_100012180447 [0,1,1,0,0,0|2,0,0]=4 1413 B14R1.134 Cc1ccc(cc1)CN(C)C(C)CO 269982a_100000693034_100000210814 [0,1,1,0,0,0|2,0,0]=4 1414 B14R1.134 Cc1ccc(cc1)CN(C)C(C)CO 270004a_100000693034_100000211033 [0,1,1,0,0,0|2,0,0]=4 1415 B14R1.134 Cc1ccc(cc1)CN(C)C(C)CO 34a_100000744650_100012180447 [0,1,1,0,0,0|2,0,0]=4 1416 B14R1.134 Cc1ccc(cc1)CN(C)[C@H](C)CO 269982a_100000744650_100016084084 [0,1,1,0,0,0|2,0,0]=4 1417 B14R1.134 Cc1ccc(cc1)NC(=O)C(O)CO 22a_100000124888_100011215603 [0,1,1,0,0,0|1,0,1]=4 1418 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000731052 [0,1,1,0,0,0|2,0,0]=4 1419 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000731052 [0,1,1,0,0,0|2,0,0]=4 1420 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000731052 [0,1,1,0,0,0|2,0,0]=4 1421 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000731052 [0,1,1,0,0,0|2,0,0]=4 1422 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)F 34a_100000185862_100000731052 [0,1,1,0,0,0|2,0,0]=4 1423 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)I 34a_100000185761_100000731052 [0,1,1,0,0,0|2,0,0]=4 1424 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)O 34a_100000185829_100000731052 [0,1,1,0,0,0|2,0,0]=4 1425 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 2230a_100000227577_100000210814 [0,1,1,0,0,0|2,0,0]=4 1426 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 2230a_100000744650_100011218427 [0,1,1,0,0,0|2,0,0]=4 1427 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 269982a_100000227577_100000210814 [0,1,1,0,0,0|2,0,0]=4 1428 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 269982a_100000744650_100011218427 [0,1,1,0,0,0|2,0,0]=4 1429 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 26a_100000227577_200020625495 [0,1,1,0,0,0|2,0,0]=4 1430 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 270004a_100000227577_100000211033 [0,1,1,0,0,0|2,0,0]=4 1431 B14R1.698 Cc1ccc(cc1)CN(C)CC(C)O 34a_100000744650_100011218427 [0,1,1,0,0,0|2,0,0]=4 1432 B14R1.698 Cc1ccc(cc1)CN(C)C[C@@H](C)O 2230a_100000744650_100009817552 [0,1,1,0,0,0|2,0,0]=4 1433 B14R1.698 Cc1ccc(cc1)CN(C)C[C@@H](C)O 269982a_100000744650_100009817552 [0,1,1,0,0,0|2,0,0]=4 1434 B14R1.698 Cc1ccc(cc1)CN(C)C[C@@H](C)O 34a_100000744650_100009817552 [0,1,1,0,0,0|2,0,0]=4 1435 B14R1.698 Cc1ccc(cc1)NC(=O)C[C@@H](C)O 22a_100000124888_100011933948 [0,1,1,0,0,0|1,0,1]=4 1436 B14R1.698 Cc1ccc(cc1)NC(C)CC(C)C 34a_100000124888_100000731052 [0,1,1,0,0,0|1,0,0]=3 1437 B14R1.698 Cc1ccc(cc1)OC(C)CC(C)C 34a_100000210336_100000731052 [0,1,1,0,0,0|2,0,0]=4 1438 B14R1.698 Cc1ccc(cc1)OC(C)CC(C)C 7a_100000210336_100000731052 [0,1,1,0,0,0|2,0,0]=4 1439 B14R1.698 Cc1ccc(cc1)SC(C)CC(C)C 62a_100000186775_100000731052 [0,1,1,0,0,0|2,0,0]=4 1440 B14R1.698 Cc1ccc(cc1)SC(C)CC(C)C 62a_100000731052_100000186775 [0,1,1,0,0,0|2,0,0]=4 1441 B14R1.954 C#Cc1ccc(cc1)NC(C)CCC 34a_100011215031_100000766640 [0,1,1,0,0,0|1,0,1]=4 1442 B14R1.954 C#Cc1ccc(cc1)NC(C)CCO 34a_100011215031_100009893172 [0,1,1,0,0,0|0,0,1]=3 1443 B14R1.954 C=Cc1ccc(cc1)NC(C)CCC 34a_100011218248_100000766640 [0,1,1,0,0,0|1,0,1]=4 1444 B14R1.954 C=Cc1ccc(cc1)NC(C)CCO 34a_100011218248_100009893172 [0,1,1,0,0,0|0,0,1]=3 1445 B14R1.954 C=Cc1ccc(cc1)OC(C)CCO 34a_100000189437_100009893172 [0,1,1,0,0,0|1,0,1]=4 1446 B14R1.954 C=Cc1ccc(cc1)OC(C)CCO 7a_100000189437_100009893172 [0,1,1,0,0,0|1,0,1]=4 1447 B14R1.954 C=Cc1ccc(cc1)SC(C)CCO 62a_100000748128_100009893172 [0,1,1,0,0,0|1,0,1]=4 1448 B14R1.954 C=Cc1ccc(cc1)SC(C)CCO 62a_100009893172_100000748128 [0,1,1,0,0,0|1,0,1]=4 1449 B14R1.954 CC(CC#N)Nc1ccc(cc1)CO 2230a_100011215238_100009813641 [0,1,1,0,0,0|1,0,1]=4 1450 B14R1.954 CC(CCO)Nc1ccc(cc1)C#N 34a_100000185469_100009893172 [0,1,1,0,0,0|0,0,1]=3 1451 B14R1.954 CC(CCO)Nc1ccc(cc1)CO 2230a_100011215238_100009893172 [0,1,1,0,0,0|0,0,0]=2 1452 B14R1.954 CC(CCO)Nc1ccc(cc1)CO 34a_100011215238_100009893172 [0,1,1,0,0,0|0,0,0]=2 1453 B14R1.954 CC(CCO)Oc1ccc(cc1)C#N 34a_100000210344_100009893172 [0,1,1,0,0,0|1,0,1]=4 1454 B14R1.954 CC(CCO)Oc1ccc(cc1)C#N 7a_100000210344_100009893172 [0,1,1,0,0,0|1,0,1]=4 1455 B14R1.954 CC(CCO)Oc1ccc(cc1)CN 34a_100000185549_100009893172 [0,1,1,0,0,0|1,0,0]=3 1456 B14R1.954 CC(CCO)Oc1ccc(cc1)CO 34a_100000211755_100009893172 [0,1,1,0,0,0|1,0,0]=3 1457 B14R1.954 CC(CCO)Oc1ccc(cn1)CN 34a_100000757128_100009893172 [0,1,1,0,0,0|2,0,0]=4 1458 B14R1.954 CC(CCO)Oc1ccc(nc1)CN 34a_100020605196_100009893172 [0,1,1,0,0,0|2,0,0]=4 1459 B14R1.954 CC(CCO)Oc1ccc(nc1)CO 34a_103436540053_100009893172 [0,1,1,0,0,0|2,0,0]=4 1460 B14R1.954 CC(CCO)Sc1ccc(cc1)C#N 62a_100009893172_100000184291 [0,1,1,0,0,0|1,0,1]=4 1461 B14R1.954 CC(CCO)Sc1ccc(cc1)C=O 62a_100000188517_100009893172 [0,1,1,0,0,0|1,0,1]=4 1462 B14R1.954 CC(CCO)Sc1ccc(cc1)C=O 62a_100009893172_100000188517 [0,1,1,0,0,0|1,0,1]=4 1463 B14R1.954 CC(CCO)Sc1ccc(cc1)CF 62a_100009893172_100010268989 [0,1,1,0,0,0|1,0,0]=3 1464 B14R1.954 CC(CCO)Sc1ccc(cc1)CF 62a_100010268989_100009893172 [0,1,1,0,0,0|1,0,0]=3 1465 B14R1.954 CC(CCO)Sc1ccc(cc1)CN 62a_100009893172_100016989417 [0,1,1,0,0,0|1,0,0]=3 1466 B14R1.954 CC(CCO)Sc1ccc(cc1)CN 62a_100016989417_100009893172 [0,1,1,0,0,0|1,0,0]=3 1467 B14R1.954 CC(CCO)Sc1ccc(cc1)CO 62a_100000690907_100009893172 [0,1,1,0,0,0|1,0,0]=3 1468 B14R1.954 CC(CCO)Sc1ccc(cc1)CO 62a_100009893172_100000690907 [0,1,1,0,0,0|1,0,0]=3 1469 B14R1.954 CC(CCO)Sc1ccc(cc1)NN 62a_100009893172_100016988836 [0,1,1,0,0,0|2,0,0]=4 1470 B14R1.954 CC(CCO)Sc1ccc(cc1)NN 62a_100016988836_100009893172 [0,1,1,0,0,0|2,0,0]=4 1471 B14R1.954 CC(CCO)Sc1ccc(cn1)CN 62a_100000735879_100009893172 [0,1,1,0,0,0|2,0,0]=4 1472 B14R1.954 CC(CCO)Sc1ccc(cn1)CN 62a_100009893172_100000735879 [0,1,1,0,0,0|2,0,0]=4 1473 B14R1.954 CC(CCO)Sc1ccc(cn1)CO 62a_100009816760_100009893172 [0,1,1,0,0,0|2,0,0]=4 1474 B14R1.954 CC(CCO)Sc1ccc(cn1)CO 62a_100009893172_100009816760 [0,1,1,0,0,0|2,0,0]=4 1475 B14R1.954 CC(CCO)Sc1ccc(nc1)CN 62a_100009893172_100015188789 [0,1,1,0,0,0|2,0,0]=4 1476 B14R1.954 CC(CCO)Sc1ccc(nc1)CN 62a_100015188789_100009893172 [0,1,1,0,0,0|2,0,0]=4 1477 B14R1.954 CC(CCO)Sc1ccc(nc1)CO 62a_100000754261_100009893172 [0,1,1,0,0,0|2,0,0]=4 1478 B14R1.954 CC(CCO)Sc1ccc(nc1)CO 62a_100009893172_100000754261 [0,1,1,0,0,0|2,0,0]=4 1479 B14R1.954 CCCC(C)Nc1ccc(cc1)C#N 34a_100000185469_100000766640 [0,1,1,0,0,0|1,0,1]=4 1480 B14R1.954 CCCC(C)Nc1ccc(cc1)CC 2230a_100000211069_100000766640 [0,1,1,0,0,0|1,0,0]=3 1481 B14R1.954 CCCC(C)Nc1ccc(cc1)CC 34a_100000211069_100000766640 [0,1,1,0,0,0|1,0,0]=3 1482 B14R1.954 CCCC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000766640 [0,1,1,0,0,0|1,0,0]=3 1483 B14R1.954 CCCC(C)Nc1ccc(cc1)CO 34a_100011215238_100000766640 [0,1,1,0,0,0|1,0,0]=3 1484 B14R1.954 CCCC(C)Nc1ccc(cc1)OC 34a_100000184247_100000766640 [0,1,1,0,0,0|1,0,0]=3 1485 B14R1.954 CCCC(C)Nc1ccc(cc1)SC 34a_100000212337_100000766640 [0,1,1,0,0,0|1,0,0]=3 1486 B14R1.954 CCCC(C)Nc1ccc(cn1)SC 27a_100000741246_100009820866 [0,1,1,0,0,0|2,0,0]=4 1487 B14R1.954 CCCC(C)Oc1ccc(cc1)CC 34a_100000211359_100000766640 [0,1,1,0,0,0|2,0,0]=4 1488 B14R1.954 CCCC(C)Oc1ccc(cc1)CC 7a_100000211359_100000766640 [0,1,1,0,0,0|2,0,0]=4 1489 B14R1.954 CCCC(C)Oc1ccc(cc1)CN 34a_100000185549_100000766640 [0,1,1,0,0,0|2,0,0]=4 1490 B14R1.954 CCCC(C)Oc1ccc(cc1)CO 34a_100000211755_100000766640 [0,1,1,0,0,0|2,0,0]=4 1491 B14R1.954 CCCC(C)Oc1ccc(cc1)NC 34a_100000182112_100000766640 [0,1,1,0,0,0|2,0,0]=4 1492 B14R1.954 CCCC(C)Oc1ccc(cc1)OC 34a_100000210503_100000766640 [0,1,1,0,0,0|2,0,0]=4 1493 B14R1.954 CCCC(C)Oc1ccc(cc1)SC 34a_100000211864_100000766640 [0,1,1,0,0,0|2,0,0]=4 1494 B14R1.954 CCCC(C)Sc1ccc(cc1)CC 62a_100000766640_100011215824 [0,1,1,0,0,0|2,0,0]=4 1495 B14R1.954 CCCC(C)Sc1ccc(cc1)CC 62a_100011215824_100000766640 [0,1,1,0,0,0|2,0,0]=4 1496 B14R1.954 CCCC(C)Sc1ccc(cc1)CF 62a_100000766640_100010268989 [0,1,1,0,0,0|2,0,0]=4 1497 B14R1.954 CCCC(C)Sc1ccc(cc1)CF 62a_100010268989_100000766640 [0,1,1,0,0,0|2,0,0]=4 1498 B14R1.954 CCCC(C)Sc1ccc(cc1)CN 62a_100000766640_100016989417 [0,1,1,0,0,0|2,0,0]=4 1499 B14R1.954 CCCC(C)Sc1ccc(cc1)CN 62a_100016989417_100000766640 [0,1,1,0,0,0|2,0,0]=4 1500 B14R1.954 CCCC(C)Sc1ccc(cc1)CO 62a_100000690907_100000766640 [0,1,1,0,0,0|2,0,0]=4 1501 B14R1.954 CCCC(C)Sc1ccc(cc1)CO 62a_100000766640_100000690907 [0,1,1,0,0,0|2,0,0]=4 1502 B14R1.954 CCCC(C)Sc1ccc(cc1)NC 62a_100000743151_100000766640 [0,1,1,0,0,0|2,0,0]=4 1503 B14R1.954 CCCC(C)Sc1ccc(cc1)NC 62a_100000766640_100000743151 [0,1,1,0,0,0|2,0,0]=4 1504 B14R1.954 CCCC(C)Sc1ccc(cc1)OC 62a_100000766640_100000171711 [0,1,1,0,0,0|2,0,0]=4 1505 B14R1.954 CCCC(C)Sc1ccc(cc1)SC 62a_100000766640_100011263217 [0,1,1,0,0,0|2,0,0]=4 1506 B14R1.954 CCCC(C)Sc1ccc(cc1)SC 62a_100011263217_100000766640 [0,1,1,0,0,0|2,0,0]=4 1507 B14R1.954 CCc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000747183 [0,1,1,0,0,0|2,0,0]=4 1508 B14R1.954 CCc1ccc(cc1)CN(C)CCO 2230a_100000683253_100000211926 [0,1,1,0,0,0|2,0,0]=4 1509 B14R1.954 CCc1ccc(cc1)CN(C)CCO 269982a_100000210263_100000747183 [0,1,1,0,0,0|2,0,0]=4 1510 B14R1.954 CCc1ccc(cc1)CN(C)CCO 269982a_100000683253_100000211926 [0,1,1,0,0,0|2,0,0]=4 1511 B14R1.954 CCc1ccc(cc1)CN(C)CCO 26a_100000210263_100000211359 [0,1,1,0,0,0|2,0,0]=4 1512 B14R1.954 CCc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000211036 [0,1,1,0,0,0|2,0,0]=4 1513 B14R1.954 CCc1ccc(cc1)NC(=O)CCO 22a_100000211069_100011216618 [0,1,1,0,0,0|1,0,1]=4 1514 B14R1.954 CCc1ccc(cc1)NC(C)CC#N 2230a_100000211069_100009813641 [0,1,1,0,0,0|1,0,1]=4 1515 B14R1.954 CCc1ccc(cc1)NC(C)CCO 2230a_100000211069_100009893172 [0,1,1,0,0,0|0,0,0]=2 1516 B14R1.954 CCc1ccc(cc1)NC(C)CCO 34a_100000211069_100009893172 [0,1,1,0,0,0|0,0,0]=2 1517 B14R1.954 CCc1ccc(cc1)NC(C)COC 2230a_100000211069_100000765312 [0,1,1,0,0,0|2,0,0]=4 1518 B14R1.954 CCc1ccc(cc1)NC(C)COC 34a_100000211069_100000765312 [0,1,1,0,0,0|2,0,0]=4 1519 B14R1.954 CCc1ccc(cc1)OC(C)CCO 34a_100000211359_100009893172 [0,1,1,0,0,0|1,0,0]=3 1520 B14R1.954 CCc1ccc(cc1)OC(C)CCO 7a_100000211359_100009893172 [0,1,1,0,0,0|1,0,0]=3 1521 B14R1.954 CCc1ccc(cc1)SC(C)CCO 62a_100009893172_100011215824 [0,1,1,0,0,0|1,0,0]=3 1522 B14R1.954 CCc1ccc(cc1)SC(C)CCO 62a_100011215824_100009893172 [0,1,1,0,0,0|1,0,0]=3 1523 B14R1.954 CCc1ccc(cn1)SC(C)CCO 62a_100009820025_100009893172 [0,1,1,0,0,0|2,0,0]=4 1524 B14R1.954 CCc1ccc(cn1)SC(C)CCO 62a_100009893172_100009820025 [0,1,1,0,0,0|2,0,0]=4 1525 B14R1.954 CCc1ccc(nc1)SC(C)CCO 62a_100009843584_100009893172 [0,1,1,0,0,0|2,0,0]=4 1526 B14R1.954 CCc1ccc(nc1)SC(C)CCO 62a_100009893172_100009843584 [0,1,1,0,0,0|2,0,0]=4 1527 B14R1.954 CCc1cnc(nc1)N[C@H](C)CCO 27a_100000706166_100000033099 [0,1,1,0,0,0|2,0,0]=4 1528 B14R1.954 CN(CCO)Cc1ccc(cc1)CO 2230a_100000210263_100000067286 [0,1,1,0,0,0|2,0,0]=4 1529 B14R1.954 CN(CCO)Cc1ccc(cc1)CO 269982a_100000210263_100000067286 [0,1,1,0,0,0|2,0,0]=4 1530 B14R1.954 CN(CCO)Cc1ccc(cc1)CO 26a_100000210263_100000211755 [0,1,1,0,0,0|2,0,0]=4 1531 B14R1.954 CN(CCO)Cc1ccc(cc1)CO 270004a_100000210263_100009832023 [0,1,1,0,0,0|2,0,0]=4 1532 B14R1.954 CNc1ccc(cc1)OC(C)CCO 34a_100000182112_100009893172 [0,1,1,0,0,0|1,0,0]=3 1533 B14R1.954 CNc1ccc(cc1)SC(C)CCO 62a_100000743151_100009893172 [0,1,1,0,0,0|1,0,0]=3 1534 B14R1.954 CNc1ccc(cc1)SC(C)CCO 62a_100009893172_100000743151 [0,1,1,0,0,0|1,0,0]=3 1535 B14R1.954 CNc1ccc(cn1)SC(C)CCO 62a_100000741341_100009893172 [0,1,1,0,0,0|2,0,0]=4 1536 B14R1.954 CNc1ccc(cn1)SC(C)CCO 62a_100009893172_100000741341 [0,1,1,0,0,0|2,0,0]=4 1537 B14R1.954 CNc1ccc(nc1)SC(C)CCO 62a_100000764248_100009893172 [0,1,1,0,0,0|2,0,0]=4 1538 B14R1.954 CNc1ccc(nc1)SC(C)CCO 62a_100009893172_100000764248 [0,1,1,0,0,0|2,0,0]=4 1539 B14R1.954 COCC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000765312 [0,1,1,0,0,0|2,0,0]=4 1540 B14R1.954 COCC(C)Nc1ccc(cc1)CO 34a_100011215238_100000765312 [0,1,1,0,0,0|2,0,0]=4 1541 B14R1.954 COCC(C)Nc1ccc(cc1)OC 34a_100000184247_100000765312 [0,1,1,0,0,0|2,0,0]=4 1542 B14R1.954 COCC(C)Nc1ccc(cc1)SC 34a_100000212337_100000765312 [0,1,1,0,0,0|2,0,0]=4 1543 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000184145_100000211926 [0,1,1,0,0,0|2,0,0]=4 1544 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000200446_200000210301 [0,1,1,0,0,0|2,0,0]=4 1545 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000742318 [0,1,1,0,0,0|2,0,0]=4 1546 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000184145_100000211926 [0,1,1,0,0,0|2,0,0]=4 1547 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000200446_200000210301 [0,1,1,0,0,0|2,0,0]=4 1548 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000210263_100000742318 [0,1,1,0,0,0|2,0,0]=4 1549 B14R1.954 COc1ccc(cc1)CN(C)CCO 26a_100000210263_100000210503 [0,1,1,0,0,0|2,0,0]=4 1550 B14R1.954 COc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000169835 [0,1,1,0,0,0|2,0,0]=4 1551 B14R1.954 COc1ccc(cc1)CN([13CH3])CCO 2230a_100000200446_200025704644 [0,1,1,0,0,0|2,0,0]=4 1552 B14R1.954 COc1ccc(cc1)CN([13CH3])CCO 269982a_100000200446_200025704644 [0,1,1,0,0,0|2,0,0]=4 1553 B14R1.954 COc1ccc(cc1)NC(=O)CCO 22a_100000184247_100011216618 [0,1,1,0,0,0|1,0,1]=4 1554 B14R1.954 COc1ccc(cc1)NC(C)CCO 34a_100000184247_100009893172 [0,1,1,0,0,0|0,0,0]=2 1555 B14R1.954 COc1ccc(cc1)OC(C)CCO 34a_100000210503_100009893172 [0,1,1,0,0,0|1,0,0]=3 1556 B14R1.954 COc1ccc(cc1)SC(C)CCO 62a_100009893172_100000171711 [0,1,1,0,0,0|1,0,0]=3 1557 B14R1.954 COc1ccc(cn1)OC(C)CCO 34a_100011934560_100009893172 [0,1,1,0,0,0|2,0,0]=4 1558 B14R1.954 COc1ccc(cn1)SC(C)CCO 62a_100000047065_100009893172 [0,1,1,0,0,0|2,0,0]=4 1559 B14R1.954 COc1ccc(cn1)SC(C)CCO 62a_100009893172_100000047065 [0,1,1,0,0,0|2,0,0]=4 1560 B14R1.954 COc1ccc(nc1)OC(C)CCO 34a_100012002028_100009893172 [0,1,1,0,0,0|2,0,0]=4 1561 B14R1.954 COc1ccc(nc1)SC(C)CCO 62a_100000755202_100009893172 [0,1,1,0,0,0|2,0,0]=4 1562 B14R1.954 COc1ccc(nc1)SC(C)CCO 62a_100009893172_100000744180 [0,1,1,0,0,0|2,0,0]=4 1563 B14R1.954 COc1ccc(nn1)N[C@H](C)CCO 27a_100000706166_100010231723 [0,1,1,0,0,0|2,0,0]=4 1564 B14R1.954 COc1cnc(nc1)N[C@H](C)CCO 27a_100000706166_100000069167 [0,1,1,0,0,0|2,0,0]=4 1565 B14R1.954 CSc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000181263 [0,1,1,0,0,0|2,0,0]=4 1566 B14R1.954 CSc1ccc(cc1)CN(C)CCO 2230a_100015185773_200000210301 [0,1,1,0,0,0|2,0,0]=4 1567 B14R1.954 CSc1ccc(cc1)CN(C)CCO 2230a_102495365258_100000211926 [0,1,1,0,0,0|2,0,0]=4 1568 B14R1.954 CSc1ccc(cc1)CN(C)CCO 269982a_100000210263_100011934452 [0,1,1,0,0,0|2,0,0]=4 1569 B14R1.954 CSc1ccc(cc1)CN(C)CCO 269982a_100015185773_200000210301 [0,1,1,0,0,0|2,0,0]=4 1570 B14R1.954 CSc1ccc(cc1)CN(C)CCO 269982a_102495365258_100000211926 [0,1,1,0,0,0|2,0,0]=4 1571 B14R1.954 CSc1ccc(cc1)CN(C)CCO 26a_100000210263_100000211864 [0,1,1,0,0,0|2,0,0]=4 1572 B14R1.954 CSc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000211154 [0,1,1,0,0,0|2,0,0]=4 1573 B14R1.954 CSc1ccc(cc1)CN([13CH3])CCO 2230a_100015185773_200025704644 [0,1,1,0,0,0|2,0,0]=4 1574 B14R1.954 CSc1ccc(cc1)CN([13CH3])CCO 269982a_100015185773_200025704644 [0,1,1,0,0,0|2,0,0]=4 1575 B14R1.954 CSc1ccc(cc1)NC(=O)CCO 22a_100000212337_100011216618 [0,1,1,0,0,0|1,0,1]=4 1576 B14R1.954 CSc1ccc(cc1)NC(C)CCO 34a_100000212337_100009893172 [0,1,1,0,0,0|0,0,0]=2 1577 B14R1.954 CSc1ccc(cc1)OC(C)CCO 34a_100000211864_100009893172 [0,1,1,0,0,0|1,0,0]=3 1578 B14R1.954 CSc1ccc(cc1)SC(C)CCO 62a_100009893172_100011263217 [0,1,1,0,0,0|1,0,0]=3 1579 B14R1.954 CSc1ccc(cc1)SC(C)CCO 62a_100011263217_100009893172 [0,1,1,0,0,0|1,0,0]=3 1580 B14R1.954 CSc1ccc(cn1)SC(C)CCO 62a_100009893172_100011408404 [0,1,1,0,0,0|2,0,0]=4 1581 B14R1.954 CSc1ccc(cn1)SC(C)CCO 62a_100011408404_100009893172 [0,1,1,0,0,0|2,0,0]=4 1582 B14R1.954 CSc1ccc(nc1)N[C@H](C)CCO 27a_100000706166_100009820866 [0,1,1,0,0,0|1,0,0]=3 1583 B14R1.954 CSc1ccc(nc1)SC(C)CCO 62a_100009820866_100009893172 [0,1,1,0,0,0|2,0,0]=4 1584 B14R1.954 CSc1ccc(nc1)SC(C)CCO 62a_100009893172_100009820866 [0,1,1,0,0,0|2,0,0]=4 1585 B14R1.954 CSc1cnc(cn1)N[C@H](C)CCO 27a_100000706166_200012356277 [0,1,1,0,0,0|2,0,0]=4 1586 B14R1.954 CSc1cnc(nc1)N[C@H](C)CCO 27a_100000706166_100000718988 [0,1,1,0,0,0|2,0,0]=4 1587 B14R1.954 C[C@H](CCO)Nc1ccc(cn1)C#N 27a_100000706166_100000241038 [0,1,1,0,0,0|1,0,1]=4 1588 B14R1.954 C[C@H](CCO)Nc1cnc(cn1)CO 27a_100000706166_100012002382 [0,1,1,0,0,0|2,0,0]=4 1589 B14R1.954 C[C@H](CCO)Nc1ncc(cn1)CO 27a_100000706166_100009855073 [0,1,1,0,0,0|2,0,0]=4 1590 B14R1.954 O=C(CCO)Nc1ccc(cc1)CO 22a_100011215238_100011216618 [0,1,1,0,0,0|1,0,1]=4 1591 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)Br 2230a_100011306057_100009893172 [0,1,1,0,0,0|1,0,0]=3 1592 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)Br 34a_100011306057_100009893172 [0,1,1,0,0,0|1,0,0]=3 1593 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)Br 7a_100011306057_100009893172 [0,1,1,0,0,0|1,0,0]=3 1594 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)Cl 2230a_100000686031_100009893172 [0,1,1,0,0,0|1,0,0]=3 1595 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)Cl 34a_100000686031_100009893172 [0,1,1,0,0,0|1,0,0]=3 1596 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)F 2230a_100000760356_100009893172 [0,1,1,0,0,0|1,0,0]=3 1597 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)F 34a_100000760356_100009893172 [0,1,1,0,0,0|1,0,0]=3 1598 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)F 7a_100000760356_100009893172 [0,1,1,0,0,0|1,0,0]=3 1599 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)I 34a_100000750458_100009893172 [0,1,1,0,0,0|1,0,0]=3 1600 B14R1.967 CC(CCO)Nc1ccc(c(c1)Br)O 34a_100011534360_100009893172 [0,1,1,0,0,0|1,0,0]=3 1601 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)Br 2230a_100000687081_100009893172 [0,1,1,0,0,0|1,0,0]=3 1602 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)Br 34a_100000687081_100009893172 [0,1,1,0,0,0|1,0,0]=3 1603 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)Br 7a_100000687081_100009893172 [0,1,1,0,0,0|1,0,0]=3 1604 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_100009893172 [0,1,1,0,0,0|1,0,0]=3 1605 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)Cl 34a_100000184108_100009893172 [0,1,1,0,0,0|1,0,0]=3 1606 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)F 2230a_100000211060_100009893172 [0,1,1,0,0,0|1,0,0]=3 1607 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)F 34a_100000211060_100009893172 [0,1,1,0,0,0|1,0,0]=3 1608 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)F 7a_100000211060_100009893172 [0,1,1,0,0,0|1,0,0]=3 1609 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)I 34a_100000761885_100009893172 [0,1,1,0,0,0|1,0,0]=3 1610 B14R1.967 CC(CCO)Nc1ccc(c(c1)Cl)O 34a_100000744943_100009893172 [0,1,1,0,0,0|1,0,0]=3 1611 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Br 2230a_100000759894_100009893172 [0,1,1,0,0,0|1,0,0]=3 1612 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Br 34a_100000759894_100009893172 [0,1,1,0,0,0|1,0,0]=3 1613 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Br 7a_100000759894_100009893172 [0,1,1,0,0,0|1,0,0]=3 1614 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Cl 2230a_100000739366_100009893172 [0,1,1,0,0,0|1,0,0]=3 1615 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Cl 34a_100000739366_100009893172 [0,1,1,0,0,0|1,0,0]=3 1616 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)Cl 7a_100000739366_100009893172 [0,1,1,0,0,0|1,0,0]=3 1617 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)F 2230a_100000210724_100009893172 [0,1,1,0,0,0|1,0,0]=3 1618 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)F 34a_100000210724_100009893172 [0,1,1,0,0,0|1,0,0]=3 1619 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)F 7a_100000210724_100009893172 [0,1,1,0,0,0|1,0,0]=3 1620 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)I 34a_100011356925_100009893172 [0,1,1,0,0,0|1,0,0]=3 1621 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)I 7a_100011356925_100009893172 [0,1,1,0,0,0|1,0,0]=3 1622 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)O 34a_100011220035_100009893172 [0,1,1,0,0,0|1,0,0]=3 1623 B14R1.967 CC(CCO)Nc1ccc(c(c1)F)O 7a_100011220035_100009893172 [0,1,1,0,0,0|1,0,0]=3 1624 B14R1.967 CC(CCO)Nc1ccc(c(c1)I)Br 34a_100000750459_100009893172 [0,1,1,0,0,0|1,0,0]=3 1625 B14R1.967 CC(CCO)Nc1ccc(c(c1)I)Cl 34a_100012360549_100009893172 [0,1,1,0,0,0|1,0,0]=3 1626 B14R1.967 CC(CCO)Nc1ccc(c(c1)I)F 34a_114828291077_100009893172 [0,1,1,0,0,0|1,0,0]=3 1627 B14R1.967 CC(CCO)Nc1ccc(c(c1)I)F 7a_114828291077_100009893172 [0,1,1,0,0,0|1,0,0]=3 1628 B14R1.967 CC(CCO)Nc1ccc(c(c1)O)Cl 34a_100011934209_100009893172 [0,1,1,0,0,0|1,0,0]=3 1629 B14R1.967 CC(CCO)Nc1ccc(c(c1)O)F 34a_100012017398_100009893172 [0,1,1,0,0,0|1,0,0]=3 1630 B14R1.967 CC(CCO)Nc1ccc(c(c1)O)F 7a_100012017398_100009893172 [0,1,1,0,0,0|1,0,0]=3 1631 B14R1.967 CC(CCO)Nc1ccc(c(c1)O)O 34a_100102946323_100009893172 [0,1,1,0,0,0|1,0,0]=3 1632 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)Cl 34a_100011933957_100009893172 [0,1,1,0,0,0|2,0,0]=4 1633 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)Cl 7a_100011933957_100009893172 [0,1,1,0,0,0|2,0,0]=4 1634 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)F 34a_100000693481_100009893172 [0,1,1,0,0,0|2,0,0]=4 1635 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)F 7a_100000693481_100009893172 [0,1,1,0,0,0|2,0,0]=4 1636 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)I 34a_100000701344_100009893172 [0,1,1,0,0,0|2,0,0]=4 1637 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)I 7a_100000701344_100009893172 [0,1,1,0,0,0|2,0,0]=4 1638 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)N 34a_100012001276_100009893172 [0,1,1,0,0,0|2,0,0]=4 1639 B14R1.967 CC(CCO)Oc1ccc(c(c1)Br)N 7a_100012001276_100009893172 [0,1,1,0,0,0|2,0,0]=4 1640 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)Br 34a_100011215161_100009893172 [0,1,1,0,0,0|2,0,0]=4 1641 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)Br 7a_100011215161_100009893172 [0,1,1,0,0,0|2,0,0]=4 1642 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)Cl 34a_100000211054_100009893172 [0,1,1,0,0,0|2,0,0]=4 1643 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)Cl 7a_100000211054_100009893172 [0,1,1,0,0,0|2,0,0]=4 1644 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)F 34a_100000211030_100009893172 [0,1,1,0,0,0|2,0,0]=4 1645 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)F 7a_100000211030_100009893172 [0,1,1,0,0,0|2,0,0]=4 1646 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)I 34a_100000047559_100009893172 [0,1,1,0,0,0|2,0,0]=4 1647 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)I 7a_100000047559_100009893172 [0,1,1,0,0,0|2,0,0]=4 1648 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)N 34a_100011215599_100009893172 [0,1,1,0,0,0|2,0,0]=4 1649 B14R1.967 CC(CCO)Oc1ccc(c(c1)Cl)N 7a_100011215599_100009893172 [0,1,1,0,0,0|2,0,0]=4 1650 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)Br 34a_100000755031_100009893172 [0,1,1,0,0,0|2,0,0]=4 1651 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)Br 7a_100000755031_100009893172 [0,1,1,0,0,0|2,0,0]=4 1652 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)Cl 34a_100000691581_100009893172 [0,1,1,0,0,0|2,0,0]=4 1653 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)Cl 7a_100000691581_100009893172 [0,1,1,0,0,0|2,0,0]=4 1654 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)F 34a_100000181275_100009893172 [0,1,1,0,0,0|2,0,0]=4 1655 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)F 7a_100000181275_100009893172 [0,1,1,0,0,0|2,0,0]=4 1656 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)I 34a_100009990212_100009893172 [0,1,1,0,0,0|2,0,0]=4 1657 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)I 7a_100009990212_100009893172 [0,1,1,0,0,0|2,0,0]=4 1658 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)N 34a_100000759473_100009893172 [0,1,1,0,0,0|2,0,0]=4 1659 B14R1.967 CC(CCO)Oc1ccc(c(c1)F)N 7a_100000759473_100009893172 [0,1,1,0,0,0|2,0,0]=4 1660 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)Br 34a_100012339312_100009893172 [0,1,1,0,0,0|2,0,0]=4 1661 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)Br 7a_100012339312_100009893172 [0,1,1,0,0,0|2,0,0]=4 1662 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)Cl 34a_100000049588_100009893172 [0,1,1,0,0,0|2,0,0]=4 1663 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)Cl 7a_100000049588_100009893172 [0,1,1,0,0,0|2,0,0]=4 1664 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)N 34a_100010084370_100009893172 [0,1,1,0,0,0|2,0,0]=4 1665 B14R1.967 CC(CCO)Oc1ccc(c(c1)I)N 7a_100010084370_100009893172 [0,1,1,0,0,0|2,0,0]=4 1666 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)Br 34a_100011999798_100009893172 [0,1,1,0,0,0|2,0,0]=4 1667 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)Br 7a_100011999798_100009893172 [0,1,1,0,0,0|2,0,0]=4 1668 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)Cl 34a_100011934297_100009893172 [0,1,1,0,0,0|2,0,0]=4 1669 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)F 34a_100012017239_100009893172 [0,1,1,0,0,0|2,0,0]=4 1670 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)F 7a_100012017239_100009893172 [0,1,1,0,0,0|2,0,0]=4 1671 B14R1.967 CC(CCO)Oc1ccc(c(c1)N)N 34a_100025771000_100009893172 [0,1,1,0,0,0|2,0,0]=4 1672 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)Br 62a_100009893172_100012356285 [0,1,1,0,0,0|2,0,0]=4 1673 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)Br 62a_100012356285_100009893172 [0,1,1,0,0,0|2,0,0]=4 1674 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)Cl 62a_100009893172_100012353702 [0,1,1,0,0,0|2,0,0]=4 1675 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)Cl 62a_100012353702_100009893172 [0,1,1,0,0,0|2,0,0]=4 1676 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)F 62a_100009893172_100012047266 [0,1,1,0,0,0|2,0,0]=4 1677 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)F 62a_100012047266_100009893172 [0,1,1,0,0,0|2,0,0]=4 1678 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)N 62a_100000750455_100009893172 [0,1,1,0,0,0|2,0,0]=4 1679 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)N 62a_100009893172_100000750455 [0,1,1,0,0,0|2,0,0]=4 1680 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)O 62a_100009893172_100012361655 [0,1,1,0,0,0|2,0,0]=4 1681 B14R1.967 CC(CCO)Sc1ccc(c(c1)Br)O 62a_100012361655_100009893172 [0,1,1,0,0,0|2,0,0]=4 1682 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)Br 62a_100009893172_100012047281 [0,1,1,0,0,0|2,0,0]=4 1683 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)Br 62a_100012047281_100009893172 [0,1,1,0,0,0|2,0,0]=4 1684 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)Cl 62a_100009893172_100011214914 [0,1,1,0,0,0|2,0,0]=4 1685 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)Cl 62a_100011214914_100009893172 [0,1,1,0,0,0|2,0,0]=4 1686 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)F 62a_100009893172_100011215976 [0,1,1,0,0,0|2,0,0]=4 1687 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)F 62a_100011215976_100009893172 [0,1,1,0,0,0|2,0,0]=4 1688 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)N 62a_100009893172_100011218065 [0,1,1,0,0,0|2,0,0]=4 1689 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)N 62a_100011218065_100009893172 [0,1,1,0,0,0|2,0,0]=4 1690 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)O 62a_100009893172_100012360047 [0,1,1,0,0,0|2,0,0]=4 1691 B14R1.967 CC(CCO)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009893172 [0,1,1,0,0,0|2,0,0]=4 1692 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)Br 62a_100000685389_100009893172 [0,1,1,0,0,0|2,0,0]=4 1693 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)Br 62a_100009893172_100000685389 [0,1,1,0,0,0|2,0,0]=4 1694 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)Cl 62a_100009893172_100011216805 [0,1,1,0,0,0|2,0,0]=4 1695 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)Cl 62a_100011216805_100009893172 [0,1,1,0,0,0|2,0,0]=4 1696 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)F 62a_100000703953_100009893172 [0,1,1,0,0,0|2,0,0]=4 1697 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)F 62a_100009893172_100000703953 [0,1,1,0,0,0|2,0,0]=4 1698 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)N 62a_100009893172_100011215594 [0,1,1,0,0,0|2,0,0]=4 1699 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)N 62a_100011215594_100009893172 [0,1,1,0,0,0|2,0,0]=4 1700 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)O 62a_100000185481_100009893172 [0,1,1,0,0,0|2,0,0]=4 1701 B14R1.967 CC(CCO)Sc1ccc(c(c1)F)O 62a_100009893172_100000185481 [0,1,1,0,0,0|2,0,0]=4 1702 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)Br 62a_100000750456_100009893172 [0,1,1,0,0,0|2,0,0]=4 1703 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)Br 62a_100009893172_100000750456 [0,1,1,0,0,0|2,0,0]=4 1704 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)Cl 62a_100009893172_200000761891 [0,1,1,0,0,0|2,0,0]=4 1705 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)Cl 62a_200000761891_100009893172 [0,1,1,0,0,0|2,0,0]=4 1706 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)F 62a_100000740924_100009893172 [0,1,1,0,0,0|2,0,0]=4 1707 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)F 62a_100009893172_100000740924 [0,1,1,0,0,0|2,0,0]=4 1708 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)N 62a_100000741789_100009893172 [0,1,1,0,0,0|2,0,0]=4 1709 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)N 62a_100009893172_100011534411 [0,1,1,0,0,0|2,0,0]=4 1710 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)O 62a_100000752626_100009893172 [0,1,1,0,0,0|2,0,0]=4 1711 B14R1.967 CC(CCO)Sc1ccc(c(c1)N)O 62a_100009893172_100000752626 [0,1,1,0,0,0|2,0,0]=4 1712 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)Br 62a_100009893172_100012356990 [0,1,1,0,0,0|2,0,0]=4 1713 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)Br 62a_100012356990_100009893172 [0,1,1,0,0,0|2,0,0]=4 1714 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)Cl 62a_100009893172_100011356854 [0,1,1,0,0,0|2,0,0]=4 1715 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009893172 [0,1,1,0,0,0|2,0,0]=4 1716 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)F 62a_100000686035_100009893172 [0,1,1,0,0,0|2,0,0]=4 1717 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)F 62a_100009893172_100000686035 [0,1,1,0,0,0|2,0,0]=4 1718 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)N 62a_100000739049_100009893172 [0,1,1,0,0,0|2,0,0]=4 1719 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)N 62a_100009893172_100000739049 [0,1,1,0,0,0|2,0,0]=4 1720 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)O 62a_100009893172_100009813601 [0,1,1,0,0,0|2,0,0]=4 1721 B14R1.967 CC(CCO)Sc1ccn(c(=O)c1)C 62a_100009820031_100009893172 [0,1,1,0,0,0|2,0,0]=4 1722 B14R1.967 CC(CCO)Sc1ccn(c(=O)c1)C 62a_100009893172_100009820031 [0,1,1,0,0,0|2,0,0]=4 1723 B14R1.967 CCCC(C)Nc1cc(c(cn1)C)F 27a_100000741246_100009841206 [0,1,1,0,0,0|2,0,0]=4 1724 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)Br 2230a_100011306057_100000766640 [0,1,1,0,0,0|2,0,0]=4 1725 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)Br 34a_100011306057_100000766640 [0,1,1,0,0,0|2,0,0]=4 1726 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)Br 7a_100011306057_100000766640 [0,1,1,0,0,0|2,0,0]=4 1727 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)C 2230a_100000736455_100000766640 [0,1,1,0,0,0|1,0,0]=3 1728 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)C 34a_100000736455_100000766640 [0,1,1,0,0,0|1,0,0]=3 1729 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)C 7a_100000736455_100000766640 [0,1,1,0,0,0|1,0,0]=3 1730 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)Cl 2230a_100000686031_100000766640 [0,1,1,0,0,0|2,0,0]=4 1731 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)Cl 34a_100000686031_100000766640 [0,1,1,0,0,0|2,0,0]=4 1732 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)F 2230a_100000760356_100000766640 [0,1,1,0,0,0|2,0,0]=4 1733 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)F 34a_100000760356_100000766640 [0,1,1,0,0,0|2,0,0]=4 1734 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)F 7a_100000760356_100000766640 [0,1,1,0,0,0|2,0,0]=4 1735 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)I 34a_100000750458_100000766640 [0,1,1,0,0,0|2,0,0]=4 1736 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000766640 [0,1,1,0,0,0|2,0,0]=4 1737 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Br 2230a_100000210723_100000766640 [0,1,1,0,0,0|2,0,0]=4 1738 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Br 34a_100000210723_100000766640 [0,1,1,0,0,0|2,0,0]=4 1739 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Br 7a_100000210723_100000766640 [0,1,1,0,0,0|2,0,0]=4 1740 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)C 2230a_100000724040_100000766640 [0,1,1,0,0,0|1,0,0]=3 1741 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)C 34a_100000724040_100000766640 [0,1,1,0,0,0|1,0,0]=3 1742 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)C 7a_100000724040_100000766640 [0,1,1,0,0,0|1,0,0]=3 1743 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Cl 2230a_100000187808_100000766640 [0,1,1,0,0,0|2,0,0]=4 1744 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Cl 34a_100000187808_100000766640 [0,1,1,0,0,0|2,0,0]=4 1745 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)Cl 7a_100000187808_100000766640 [0,1,1,0,0,0|2,0,0]=4 1746 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)F 2230a_100000750164_100000766640 [0,1,1,0,0,0|2,0,0]=4 1747 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)F 34a_100000750164_100000766640 [0,1,1,0,0,0|2,0,0]=4 1748 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)F 7a_100000750164_100000766640 [0,1,1,0,0,0|2,0,0]=4 1749 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)I 34a_100000198070_100000766640 [0,1,1,0,0,0|2,0,0]=4 1750 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)I 7a_100000198070_100000766640 [0,1,1,0,0,0|2,0,0]=4 1751 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100000766640 [0,1,1,0,0,0|2,0,0]=4 1752 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000766640 [0,1,1,0,0,0|2,0,0]=4 1753 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)Br 2230a_100000687081_100000766640 [0,1,1,0,0,0|2,0,0]=4 1754 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)Br 34a_100000687081_100000766640 [0,1,1,0,0,0|2,0,0]=4 1755 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)Br 7a_100000687081_100000766640 [0,1,1,0,0,0|2,0,0]=4 1756 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)C 2230a_100000188892_100000766640 [0,1,1,0,0,0|1,0,0]=3 1757 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)C 34a_100000188892_100000766640 [0,1,1,0,0,0|1,0,0]=3 1758 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)C 7a_100000188892_100000766640 [0,1,1,0,0,0|1,0,0]=3 1759 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000766640 [0,1,1,0,0,0|2,0,0]=4 1760 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)Cl 34a_100000184108_100000766640 [0,1,1,0,0,0|2,0,0]=4 1761 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)F 2230a_100000211060_100000766640 [0,1,1,0,0,0|2,0,0]=4 1762 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)F 34a_100000211060_100000766640 [0,1,1,0,0,0|2,0,0]=4 1763 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)F 7a_100000211060_100000766640 [0,1,1,0,0,0|2,0,0]=4 1764 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)I 34a_100000761885_100000766640 [0,1,1,0,0,0|2,0,0]=4 1765 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000766640 [0,1,1,0,0,0|2,0,0]=4 1766 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Br 2230a_100000759894_100000766640 [0,1,1,0,0,0|2,0,0]=4 1767 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Br 34a_100000759894_100000766640 [0,1,1,0,0,0|2,0,0]=4 1768 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Br 7a_100000759894_100000766640 [0,1,1,0,0,0|2,0,0]=4 1769 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)C 2230a_100000210958_100000766640 [0,1,1,0,0,0|1,0,0]=3 1770 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)C 34a_100000210958_100000766640 [0,1,1,0,0,0|1,0,0]=3 1771 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)C 7a_100000210958_100000766640 [0,1,1,0,0,0|1,0,0]=3 1772 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Cl 2230a_100000739366_100000766640 [0,1,1,0,0,0|2,0,0]=4 1773 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Cl 34a_100000739366_100000766640 [0,1,1,0,0,0|2,0,0]=4 1774 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)Cl 7a_100000739366_100000766640 [0,1,1,0,0,0|2,0,0]=4 1775 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)F 2230a_100000210724_100000766640 [0,1,1,0,0,0|2,0,0]=4 1776 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)F 34a_100000210724_100000766640 [0,1,1,0,0,0|2,0,0]=4 1777 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)F 7a_100000210724_100000766640 [0,1,1,0,0,0|2,0,0]=4 1778 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)I 34a_100011356925_100000766640 [0,1,1,0,0,0|2,0,0]=4 1779 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)I 7a_100011356925_100000766640 [0,1,1,0,0,0|2,0,0]=4 1780 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000766640 [0,1,1,0,0,0|2,0,0]=4 1781 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000766640 [0,1,1,0,0,0|2,0,0]=4 1782 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)Br 34a_100000750459_100000766640 [0,1,1,0,0,0|2,0,0]=4 1783 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)C 34a_100000184131_100000766640 [0,1,1,0,0,0|1,0,0]=3 1784 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)C 7a_100000184131_100000766640 [0,1,1,0,0,0|1,0,0]=3 1785 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)Cl 34a_100012360549_100000766640 [0,1,1,0,0,0|2,0,0]=4 1786 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)F 34a_114828291077_100000766640 [0,1,1,0,0,0|2,0,0]=4 1787 B14R1.967 CCCC(C)Nc1ccc(c(c1)I)F 7a_114828291077_100000766640 [0,1,1,0,0,0|2,0,0]=4 1788 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100000766640 [0,1,1,0,0,0|1,0,0]=3 1789 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000766640 [0,1,1,0,0,0|1,0,0]=3 1790 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000766640 [0,1,1,0,0,0|2,0,0]=4 1791 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000766640 [0,1,1,0,0,0|2,0,0]=4 1792 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000766640 [0,1,1,0,0,0|2,0,0]=4 1793 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000766640 [0,1,1,0,0,0|2,0,0]=4 1794 B14R1.967 CCCC(C)Nc1ccn(c(=O)c1)C 27a_100000741246_100009820031 [0,1,1,0,0,0|2,0,0]=4 1795 B14R1.967 CCCC(C)Oc1ccc(c(c1)Br)C 34a_100011380479_100000766640 [0,1,1,0,0,0|2,0,0]=4 1796 B14R1.967 CCCC(C)Oc1ccc(c(c1)Br)C 7a_100011380479_100000766640 [0,1,1,0,0,0|2,0,0]=4 1797 B14R1.967 CCCC(C)Oc1ccc(c(c1)C)C 34a_100000210932_100000766640 [0,1,1,0,0,0|2,0,0]=4 1798 B14R1.967 CCCC(C)Oc1ccc(c(c1)C)C 7a_100000210932_100000766640 [0,1,1,0,0,0|2,0,0]=4 1799 B14R1.967 CCCC(C)Oc1ccc(c(c1)Cl)C 34a_100011265682_100000766640 [0,1,1,0,0,0|2,0,0]=4 1800 B14R1.967 CCCC(C)Oc1ccc(c(c1)Cl)C 7a_100011265682_100000766640 [0,1,1,0,0,0|2,0,0]=4 1801 B14R1.967 CCCC(C)Oc1ccc(c(c1)F)C 34a_100000722560_100000766640 [0,1,1,0,0,0|2,0,0]=4 1802 B14R1.967 CCCC(C)Oc1ccc(c(c1)F)C 7a_100000722560_100000766640 [0,1,1,0,0,0|2,0,0]=4 1803 B14R1.967 CCCC(C)Oc1ccc(c(c1)N)C 34a_100011216113_100000766640 [0,1,1,0,0,0|2,0,0]=4 1804 B14R1.967 CCCC(C)Oc1ccc(c(c1)N)C 7a_100011216113_100000766640 [0,1,1,0,0,0|2,0,0]=4 1805 B14R1.967 CCCC(C)Sc1ccc(c(c1)Br)C 62a_100000766640_100011847877 [0,1,1,0,0,0|2,0,0]=4 1806 B14R1.967 CCCC(C)Sc1ccc(c(c1)Br)C 62a_100011847877_100000766640 [0,1,1,0,0,0|2,0,0]=4 1807 B14R1.967 CCCC(C)Sc1ccc(c(c1)C)C 62a_100000766640_100011215607 [0,1,1,0,0,0|2,0,0]=4 1808 B14R1.967 CCCC(C)Sc1ccc(c(c1)C)C 62a_100011215607_100000766640 [0,1,1,0,0,0|2,0,0]=4 1809 B14R1.967 CCCC(C)Sc1ccc(c(c1)Cl)C 62a_100000766640_100011216363 [0,1,1,0,0,0|2,0,0]=4 1810 B14R1.967 CCCC(C)Sc1ccc(c(c1)Cl)C 62a_100011216363_100000766640 [0,1,1,0,0,0|2,0,0]=4 1811 B14R1.967 CCCC(C)Sc1ccc(c(c1)F)C 62a_100000720648_100000766640 [0,1,1,0,0,0|2,0,0]=4 1812 B14R1.967 CCCC(C)Sc1ccc(c(c1)F)C 62a_100000766640_100000720648 [0,1,1,0,0,0|2,0,0]=4 1813 B14R1.967 CCCC(C)Sc1ccc(c(c1)N)C 62a_100000761890_100000766640 [0,1,1,0,0,0|2,0,0]=4 1814 B14R1.967 CCCC(C)Sc1ccc(c(c1)N)C 62a_100000766640_100000761890 [0,1,1,0,0,0|2,0,0]=4 1815 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000766640 [0,1,1,0,0,0|2,0,0]=4 1816 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)C 62a_100000766640_100000685420 [0,1,1,0,0,0|2,0,0]=4 1817 B14R1.967 COCC(C)Nc1ccc(c(c1)Br)C 2230a_100000736455_100000765312 [0,1,1,0,0,0|2,0,0]=4 1818 B14R1.967 COCC(C)Nc1ccc(c(c1)Br)C 34a_100000736455_100000765312 [0,1,1,0,0,0|2,0,0]=4 1819 B14R1.967 COCC(C)Nc1ccc(c(c1)Br)C 7a_100000736455_100000765312 [0,1,1,0,0,0|2,0,0]=4 1820 B14R1.967 COCC(C)Nc1ccc(c(c1)C)C 2230a_100000724040_100000765312 [0,1,1,0,0,0|2,0,0]=4 1821 B14R1.967 COCC(C)Nc1ccc(c(c1)C)C 34a_100000724040_100000765312 [0,1,1,0,0,0|2,0,0]=4 1822 B14R1.967 COCC(C)Nc1ccc(c(c1)C)C 7a_100000724040_100000765312 [0,1,1,0,0,0|2,0,0]=4 1823 B14R1.967 COCC(C)Nc1ccc(c(c1)Cl)C 2230a_100000188892_100000765312 [0,1,1,0,0,0|2,0,0]=4 1824 B14R1.967 COCC(C)Nc1ccc(c(c1)Cl)C 34a_100000188892_100000765312 [0,1,1,0,0,0|2,0,0]=4 1825 B14R1.967 COCC(C)Nc1ccc(c(c1)Cl)C 7a_100000188892_100000765312 [0,1,1,0,0,0|2,0,0]=4 1826 B14R1.967 COCC(C)Nc1ccc(c(c1)F)C 2230a_100000210958_100000765312 [0,1,1,0,0,0|2,0,0]=4 1827 B14R1.967 COCC(C)Nc1ccc(c(c1)F)C 34a_100000210958_100000765312 [0,1,1,0,0,0|2,0,0]=4 1828 B14R1.967 COCC(C)Nc1ccc(c(c1)F)C 7a_100000210958_100000765312 [0,1,1,0,0,0|2,0,0]=4 1829 B14R1.967 COCC(C)Nc1ccc(c(c1)I)C 34a_100000184131_100000765312 [0,1,1,0,0,0|2,0,0]=4 1830 B14R1.967 COCC(C)Nc1ccc(c(c1)I)C 7a_100000184131_100000765312 [0,1,1,0,0,0|2,0,0]=4 1831 B14R1.967 COCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100000765312 [0,1,1,0,0,0|2,0,0]=4 1832 B14R1.967 COCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000765312 [0,1,1,0,0,0|2,0,0]=4 1833 B14R1.967 C[C@H](CCO)Nc1cc(=O)n(cn1)C 27a_100000706166_100012179353 [0,1,1,0,0,0|2,0,0]=4 1834 B14R1.967 C[C@H](CCO)Nc1ccc(c(n1)F)Br 27a_100000706166_100010134343 [0,1,1,0,0,0|2,0,0]=4 1835 B14R1.967 C[C@H](CCO)Nc1ccn(c(=O)c1)C 27a_100000706166_100009820031 [0,1,1,0,0,0|1,0,0]=3 1836 B14R1.967 Cc1cc(ccc1Br)NC(C)CCO 2230a_100000210723_100009893172 [0,1,1,0,0,0|1,0,0]=3 1837 B14R1.967 Cc1cc(ccc1Br)NC(C)CCO 34a_100000210723_100009893172 [0,1,1,0,0,0|1,0,0]=3 1838 B14R1.967 Cc1cc(ccc1Br)NC(C)CCO 7a_100000210723_100009893172 [0,1,1,0,0,0|1,0,0]=3 1839 B14R1.967 Cc1cc(ccc1Br)OC(C)CCO 34a_100000690111_100009893172 [0,1,1,0,0,0|2,0,0]=4 1840 B14R1.967 Cc1cc(ccc1Br)OC(C)CCO 7a_100000690111_100009893172 [0,1,1,0,0,0|2,0,0]=4 1841 B14R1.967 Cc1cc(ccc1Br)SC(C)CCO 62a_100009813585_100009893172 [0,1,1,0,0,0|2,0,0]=4 1842 B14R1.967 Cc1cc(ccc1Br)SC(C)CCO 62a_100009893172_100009813585 [0,1,1,0,0,0|2,0,0]=4 1843 B14R1.967 Cc1cc(ccc1Cl)NC(C)CCO 2230a_100000187808_100009893172 [0,1,1,0,0,0|1,0,0]=3 1844 B14R1.967 Cc1cc(ccc1Cl)NC(C)CCO 34a_100000187808_100009893172 [0,1,1,0,0,0|1,0,0]=3 1845 B14R1.967 Cc1cc(ccc1Cl)NC(C)CCO 7a_100000187808_100009893172 [0,1,1,0,0,0|1,0,0]=3 1846 B14R1.967 Cc1cc(ccc1Cl)OC(C)CCO 34a_100000211092_100009893172 [0,1,1,0,0,0|2,0,0]=4 1847 B14R1.967 Cc1cc(ccc1Cl)OC(C)CCO 7a_100000211092_100009893172 [0,1,1,0,0,0|2,0,0]=4 1848 B14R1.967 Cc1cc(ccc1Cl)SC(C)CCO 62a_100000049509_100009893172 [0,1,1,0,0,0|2,0,0]=4 1849 B14R1.967 Cc1cc(ccc1Cl)SC(C)CCO 62a_100009893172_100000049509 [0,1,1,0,0,0|2,0,0]=4 1850 B14R1.967 Cc1cc(ccc1F)NC(C)CCO 2230a_100000750164_100009893172 [0,1,1,0,0,0|1,0,0]=3 1851 B14R1.967 Cc1cc(ccc1F)NC(C)CCO 34a_100000750164_100009893172 [0,1,1,0,0,0|1,0,0]=3 1852 B14R1.967 Cc1cc(ccc1F)NC(C)CCO 7a_100000750164_100009893172 [0,1,1,0,0,0|1,0,0]=3 1853 B14R1.967 Cc1cc(ccc1F)OC(C)CCO 34a_100000751312_100009893172 [0,1,1,0,0,0|2,0,0]=4 1854 B14R1.967 Cc1cc(ccc1F)OC(C)CCO 7a_100000751312_100009893172 [0,1,1,0,0,0|2,0,0]=4 1855 B14R1.967 Cc1cc(ccc1F)SC(C)CCO 62a_100009893172_100011218330 [0,1,1,0,0,0|2,0,0]=4 1856 B14R1.967 Cc1cc(ccc1F)SC(C)CCO 62a_100011218330_100009893172 [0,1,1,0,0,0|2,0,0]=4 1857 B14R1.967 Cc1cc(ccc1I)NC(C)CCO 34a_100000198070_100009893172 [0,1,1,0,0,0|1,0,0]=3 1858 B14R1.967 Cc1cc(ccc1I)NC(C)CCO 7a_100000198070_100009893172 [0,1,1,0,0,0|1,0,0]=3 1859 B14R1.967 Cc1cc(ccc1I)OC(C)CCO 34a_100000729255_100009893172 [0,1,1,0,0,0|2,0,0]=4 1860 B14R1.967 Cc1cc(ccc1I)OC(C)CCO 7a_100000729255_100009893172 [0,1,1,0,0,0|2,0,0]=4 1861 B14R1.967 Cc1cc(ccc1N)OC(C)CCO 34a_100000756630_100009893172 [0,1,1,0,0,0|2,0,0]=4 1862 B14R1.967 Cc1cc(ccc1N)OC(C)CCO 7a_100000756630_100009893172 [0,1,1,0,0,0|2,0,0]=4 1863 B14R1.967 Cc1cc(ccc1N)SC(C)CCO 62a_100000211769_100009893172 [0,1,1,0,0,0|2,0,0]=4 1864 B14R1.967 Cc1cc(ccc1N)SC(C)CCO 62a_100009893172_100000211769 [0,1,1,0,0,0|2,0,0]=4 1865 B14R1.967 Cc1cc(ccc1O)NC(C)CCO 34a_100011218179_100009893172 [0,1,1,0,0,0|1,0,0]=3 1866 B14R1.967 Cc1cc(ccc1O)NC(C)CCO 7a_100011218179_100009893172 [0,1,1,0,0,0|1,0,0]=3 1867 B14R1.967 Cc1cc(ccc1O)SC(C)CCO 62a_100009893172_100000186361 [0,1,1,0,0,0|2,0,0]=4 1868 B14R1.967 Cc1cc(cnc1C)OC(C)CCO 34a_100009854398_100009893172 [0,1,1,0,0,0|2,0,0]=4 1869 B14R1.967 Cc1cc(cnc1C)OC(C)CCO 7a_100009854398_100009893172 [0,1,1,0,0,0|2,0,0]=4 1870 B14R1.967 Cc1cc(cnc1C)SC(C)CCO 62a_100000697892_100009893172 [0,1,1,0,0,0|2,0,0]=4 1871 B14R1.967 Cc1cc(cnc1C)SC(C)CCO 62a_100009893172_100000697892 [0,1,1,0,0,0|2,0,0]=4 1872 B14R1.967 Cc1ccc(c[n+]1[O-])SC(C)CCO 62a_100009893172_100000703231 [0,1,1,0,0,0|2,0,0]=4 1873 B14R1.967 Cc1ccc(cc1Br)CN(C)CCO 2230a_100000210263_100012232412 [0,1,1,0,0,0|2,0,0]=4 1874 B14R1.967 Cc1ccc(cc1Br)CN(C)CCO 269982a_100000210263_100012232412 [0,1,1,0,0,0|2,0,0]=4 1875 B14R1.967 Cc1ccc(cc1Br)CN(C)CCO 26a_100000210263_100011380479 [0,1,1,0,0,0|2,0,0]=4 1876 B14R1.967 Cc1ccc(cc1Br)CN(C)CCO 270004a_100000210263_100000695567 [0,1,1,0,0,0|2,0,0]=4 1877 B14R1.967 Cc1ccc(cc1Br)NC(=O)CCO 22a_100000736455_100011216618 [0,1,1,0,0,0|1,0,1]=4 1878 B14R1.967 Cc1ccc(cc1Br)NC(C)CC#N 2230a_100000736455_100009813641 [0,1,1,0,0,0|1,0,1]=4 1879 B14R1.967 Cc1ccc(cc1Br)NC(C)CC#N 7a_100000736455_100009813641 [0,1,1,0,0,0|1,0,1]=4 1880 B14R1.967 Cc1ccc(cc1Br)NC(C)CCO 2230a_100000736455_100009893172 [0,1,1,0,0,0|0,0,0]=2 1881 B14R1.967 Cc1ccc(cc1Br)NC(C)CCO 34a_100000736455_100009893172 [0,1,1,0,0,0|0,0,0]=2 1882 B14R1.967 Cc1ccc(cc1Br)NC(C)CCO 7a_100000736455_100009893172 [0,1,1,0,0,0|0,0,0]=2 1883 B14R1.967 Cc1ccc(cc1Br)OC(C)CCO 34a_100011380479_100009893172 [0,1,1,0,0,0|1,0,0]=3 1884 B14R1.967 Cc1ccc(cc1Br)OC(C)CCO 7a_100011380479_100009893172 [0,1,1,0,0,0|1,0,0]=3 1885 B14R1.967 Cc1ccc(cc1Br)SC(C)CCO 62a_100009893172_100011847877 [0,1,1,0,0,0|1,0,0]=3 1886 B14R1.967 Cc1ccc(cc1Br)SC(C)CCO 62a_100011847877_100009893172 [0,1,1,0,0,0|1,0,0]=3 1887 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 2230a_100000210263_100000742320 [0,1,1,0,0,0|2,0,0]=4 1888 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 2230a_100015204808_100000211926 [0,1,1,0,0,0|2,0,0]=4 1889 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 269982a_100000210263_100000742320 [0,1,1,0,0,0|2,0,0]=4 1890 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 269982a_100015204808_100000211926 [0,1,1,0,0,0|2,0,0]=4 1891 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 270004a_100000210263_100000229942 [0,1,1,0,0,0|2,0,0]=4 1892 B14R1.967 Cc1ccc(cc1C)CN(C)CCO 34a_100015204808_100000211926 [0,1,1,0,0,0|2,0,0]=4 1893 B14R1.967 Cc1ccc(cc1C)NC(=O)CCO 22a_100000724040_100011216618 [0,1,1,0,0,0|1,0,1]=4 1894 B14R1.967 Cc1ccc(cc1C)NC(C)CC#N 2230a_100000724040_100009813641 [0,1,1,0,0,0|1,0,1]=4 1895 B14R1.967 Cc1ccc(cc1C)NC(C)CC#N 7a_100000724040_100009813641 [0,1,1,0,0,0|1,0,1]=4 1896 B14R1.967 Cc1ccc(cc1C)NC(C)CCO 2230a_100000724040_100009893172 [0,1,1,0,0,0|0,0,0]=2 1897 B14R1.967 Cc1ccc(cc1C)NC(C)CCO 34a_100000724040_100009893172 [0,1,1,0,0,0|0,0,0]=2 1898 B14R1.967 Cc1ccc(cc1C)NC(C)CCO 7a_100000724040_100009893172 [0,1,1,0,0,0|0,0,0]=2 1899 B14R1.967 Cc1ccc(cc1C)OC(C)CCO 34a_100000210932_100009893172 [0,1,1,0,0,0|1,0,0]=3 1900 B14R1.967 Cc1ccc(cc1C)OC(C)CCO 7a_100000210932_100009893172 [0,1,1,0,0,0|1,0,0]=3 1901 B14R1.967 Cc1ccc(cc1C)SC(C)CCO 62a_100009893172_100011215607 [0,1,1,0,0,0|1,0,0]=3 1902 B14R1.967 Cc1ccc(cc1C)SC(C)CCO 62a_100011215607_100009893172 [0,1,1,0,0,0|1,0,0]=3 1903 B14R1.967 Cc1ccc(cc1Cl)CN(C)CCO 2230a_100000210263_100011823929 [0,1,1,0,0,0|2,0,0]=4 1904 B14R1.967 Cc1ccc(cc1Cl)CN(C)CCO 269982a_100000210263_100011823929 [0,1,1,0,0,0|2,0,0]=4 1905 B14R1.967 Cc1ccc(cc1Cl)CN(C)CCO 26a_100000210263_100011265682 [0,1,1,0,0,0|2,0,0]=4 1906 B14R1.967 Cc1ccc(cc1Cl)CN(C)CCO 270004a_100000210263_100000760539 [0,1,1,0,0,0|2,0,0]=4 1907 B14R1.967 Cc1ccc(cc1Cl)NC(=O)CCO 22a_100000188892_100011216618 [0,1,1,0,0,0|1,0,1]=4 1908 B14R1.967 Cc1ccc(cc1Cl)NC(C)CC#N 2230a_100000188892_100009813641 [0,1,1,0,0,0|1,0,1]=4 1909 B14R1.967 Cc1ccc(cc1Cl)NC(C)CC#N 7a_100000188892_100009813641 [0,1,1,0,0,0|1,0,1]=4 1910 B14R1.967 Cc1ccc(cc1Cl)NC(C)CCO 2230a_100000188892_100009893172 [0,1,1,0,0,0|0,0,0]=2 1911 B14R1.967 Cc1ccc(cc1Cl)NC(C)CCO 34a_100000188892_100009893172 [0,1,1,0,0,0|0,0,0]=2 1912 B14R1.967 Cc1ccc(cc1Cl)NC(C)CCO 7a_100000188892_100009893172 [0,1,1,0,0,0|0,0,0]=2 1913 B14R1.967 Cc1ccc(cc1Cl)OC(C)CCO 34a_100011265682_100009893172 [0,1,1,0,0,0|1,0,0]=3 1914 B14R1.967 Cc1ccc(cc1Cl)OC(C)CCO 7a_100011265682_100009893172 [0,1,1,0,0,0|1,0,0]=3 1915 B14R1.967 Cc1ccc(cc1Cl)SC(C)CCO 62a_100009893172_100011216363 [0,1,1,0,0,0|1,0,0]=3 1916 B14R1.967 Cc1ccc(cc1Cl)SC(C)CCO 62a_100011216363_100009893172 [0,1,1,0,0,0|1,0,0]=3 1917 B14R1.967 Cc1ccc(cc1F)CN(C)CCO 2230a_100000210263_100011217369 [0,1,1,0,0,0|2,0,0]=4 1918 B14R1.967 Cc1ccc(cc1F)CN(C)CCO 269982a_100000210263_100011217369 [0,1,1,0,0,0|2,0,0]=4 1919 B14R1.967 Cc1ccc(cc1F)CN(C)CCO 270004a_100000210263_100000753222 [0,1,1,0,0,0|2,0,0]=4 1920 B14R1.967 Cc1ccc(cc1F)NC(=O)CCO 22a_100000210958_100011216618 [0,1,1,0,0,0|1,0,1]=4 1921 B14R1.967 Cc1ccc(cc1F)NC(C)CC#N 2230a_100000210958_100009813641 [0,1,1,0,0,0|1,0,1]=4 1922 B14R1.967 Cc1ccc(cc1F)NC(C)CC#N 7a_100000210958_100009813641 [0,1,1,0,0,0|1,0,1]=4 1923 B14R1.967 Cc1ccc(cc1F)NC(C)CCO 2230a_100000210958_100009893172 [0,1,1,0,0,0|0,0,0]=2 1924 B14R1.967 Cc1ccc(cc1F)NC(C)CCO 34a_100000210958_100009893172 [0,1,1,0,0,0|0,0,0]=2 1925 B14R1.967 Cc1ccc(cc1F)NC(C)CCO 7a_100000210958_100009893172 [0,1,1,0,0,0|0,0,0]=2 1926 B14R1.967 Cc1ccc(cc1F)OC(C)CCO 34a_100000722560_100009893172 [0,1,1,0,0,0|1,0,0]=3 1927 B14R1.967 Cc1ccc(cc1F)OC(C)CCO 7a_100000722560_100009893172 [0,1,1,0,0,0|1,0,0]=3 1928 B14R1.967 Cc1ccc(cc1F)SC(C)CCO 62a_100000720648_100009893172 [0,1,1,0,0,0|1,0,0]=3 1929 B14R1.967 Cc1ccc(cc1F)SC(C)CCO 62a_100009893172_100000720648 [0,1,1,0,0,0|1,0,0]=3 1930 B14R1.967 Cc1ccc(cc1I)CN(C)CCO 2230a_100000210263_100010206137 [0,1,1,0,0,0|2,0,0]=4 1931 B14R1.967 Cc1ccc(cc1I)CN(C)CCO 269982a_100000210263_100010206137 [0,1,1,0,0,0|2,0,0]=4 1932 B14R1.967 Cc1ccc(cc1I)CN(C)CCO 270004a_100000210263_100010197721 [0,1,1,0,0,0|2,0,0]=4 1933 B14R1.967 Cc1ccc(cc1I)NC(=O)CCO 22a_100000184131_100011216618 [0,1,1,0,0,0|1,0,1]=4 1934 B14R1.967 Cc1ccc(cc1I)NC(C)CC#N 7a_100000184131_100009813641 [0,1,1,0,0,0|1,0,1]=4 1935 B14R1.967 Cc1ccc(cc1I)NC(C)CCO 34a_100000184131_100009893172 [0,1,1,0,0,0|0,0,0]=2 1936 B14R1.967 Cc1ccc(cc1I)NC(C)CCO 7a_100000184131_100009893172 [0,1,1,0,0,0|0,0,0]=2 1937 B14R1.967 Cc1ccc(cc1N)OC(C)CCO 34a_100011216113_100009893172 [0,1,1,0,0,0|1,0,0]=3 1938 B14R1.967 Cc1ccc(cc1N)OC(C)CCO 7a_100011216113_100009893172 [0,1,1,0,0,0|1,0,0]=3 1939 B14R1.967 Cc1ccc(cc1N)SC(C)CCO 62a_100000761890_100009893172 [0,1,1,0,0,0|1,0,0]=3 1940 B14R1.967 Cc1ccc(cc1N)SC(C)CCO 62a_100009893172_100000761890 [0,1,1,0,0,0|1,0,0]=3 1941 B14R1.967 Cc1ccc(cc1O)NC(=O)CCO 22a_100000759471_100011216618 [0,1,1,0,0,0|1,0,1]=4 1942 B14R1.967 Cc1ccc(cc1O)NC(C)CC#N 7a_100000759471_100009813641 [0,1,1,0,0,0|1,0,1]=4 1943 B14R1.967 Cc1ccc(cc1O)NC(C)CCO 34a_100000759471_100009893172 [0,1,1,0,0,0|0,0,0]=2 1944 B14R1.967 Cc1ccc(cc1O)NC(C)CCO 7a_100000759471_100009893172 [0,1,1,0,0,0|0,0,0]=2 1945 B14R1.967 Cc1ccc(cc1O)SC(C)CCO 62a_100000685420_100009893172 [0,1,1,0,0,0|1,0,0]=3 1946 B14R1.967 Cc1ccc(cc1O)SC(C)CCO 62a_100009893172_100000685420 [0,1,1,0,0,0|1,0,0]=3 1947 B14R1.967 Cc1ccc(nc1C)SC(C)CCO 62a_100000103781_100009893172 [0,1,1,0,0,0|2,0,0]=4 1948 B14R1.967 Cc1ccc(nc1C)SC(C)CCO 62a_100009893172_100000103781 [0,1,1,0,0,0|2,0,0]=4 1949 B14R1.967 Cc1ccc(nc1N)SC(C)CCO 62a_100009857032_100009893172 [0,1,1,0,0,0|2,0,0]=4 1950 B14R1.967 Cc1ccc(nc1N)SC(C)CCO 62a_100009893172_100009857032 [0,1,1,0,0,0|2,0,0]=4 1951 B14R1.967 Cc1cnc(cc1Br)OC(C)CCO 34a_100009831917_100009893172 [0,1,1,0,0,0|2,0,0]=4 1952 B14R1.967 Cc1cnc(cc1C)SC(C)CCO 62a_100009850809_100009893172 [0,1,1,0,0,0|2,0,0]=4 1953 B14R1.967 Cc1cnc(cc1C)SC(C)CCO 62a_100009893172_100009850809 [0,1,1,0,0,0|2,0,0]=4 1954 B14R1.967 Cc1cnc(cc1F)N[C@H](C)CCO 27a_100000706166_100009841206 [0,1,1,0,0,0|1,0,0]=3 1955 B14R1.967 Cc1cnc(cc1F)SC(C)CCO 62a_100009841206_100009893172 [0,1,1,0,0,0|2,0,0]=4 1956 B14R1.967 Cc1cnc(cc1F)SC(C)CCO 62a_100009893172_100009841206 [0,1,1,0,0,0|2,0,0]=4 1957 B14R1.967 Cc1cnc(cc1N)SC(C)CCO 62a_100000126663_100009893172 [0,1,1,0,0,0|2,0,0]=4 1958 B14R1.967 Cc1cnc(cc1N)SC(C)CCO 62a_100009893172_100000126663 [0,1,1,0,0,0|2,0,0]=4 1959 B14R1.967 Cc1cnc(cc1O)SC(C)CCO 62a_100000704368_100009893172 [0,1,1,0,0,0|2,0,0]=4 1960 B14R1.967 Cc1cnc(cc1O)SC(C)CCO 62a_100009893172_100000704368 [0,1,1,0,0,0|2,0,0]=4 1961 B14R1.967 Cc1cnc(nc1N)N[C@H](C)CCO 27a_100000706166_100011996698 [0,1,1,0,0,0|2,0,0]=4 1962 B14R1.967 Cc1ncc(cc1Br)OC(C)CCO 34a_100009819603_100009893172 [0,1,1,0,0,0|2,0,0]=4 1963 B14R1.967 Cc1ncc(cc1Br)OC(C)CCO 7a_100009819603_100009893172 [0,1,1,0,0,0|2,0,0]=4 1964 B14R1.967 Cc1ncc(cc1F)SC(C)CCO 62a_100009845756_100009893172 [0,1,1,0,0,0|2,0,0]=4 1965 B14R1.967 Cc1ncc(cc1F)SC(C)CCO 62a_100009893172_100009845756 [0,1,1,0,0,0|2,0,0]=4 1966 B14R1.967 Cc1ncc(cc1N)SC(C)CCO 62a_100009893172_100011999542 [0,1,1,0,0,0|2,0,0]=4 1967 B14R1.967 Cc1ncc(cc1N)SC(C)CCO 62a_100011999542_100009893172 [0,1,1,0,0,0|2,0,0]=4 1968 B14R1.967 Cc1ncc(cc1O)SC(C)CCO 62a_100009864810_100009893172 [0,1,1,0,0,0|2,0,0]=4 1969 B14R1.967 Cc1ncc(cc1O)SC(C)CCO 62a_100009893172_100009864810 [0,1,1,0,0,0|2,0,0]=4 1970 B14R1.967 Cc1ncc(nc1C)N[C@H](C)CCO 27a_100000706166_100009878948 [0,1,1,0,0,0|2,0,0]=4 1971 B14R1.6817 CC(C)(CCO)Nc1ccc(cn1)Br 27a_100000763138_100000686858 [0,1,1,0,0,0|2,0,0]=4 1972 B14R1.6817 Cc1ccc(nn1)NC(C)(C)CCO 27a_100000763138_100000744512 [0,1,1,0,0,0|2,0,0]=4 1973 B14R1.6817 Cc1cnc(cn1)NC(C)(C)CCO 27a_100000763138_100000074397 [0,1,1,0,0,0|2,0,0]=4 1974 B14R1.6817 Cc1cnc(nc1)NC(C)(C)CCO 27a_100000763138_100000061069 [0,1,1,0,0,0|2,0,0]=4 1975 B14R1.6823 CC(CCO)Nc1ccc(cc1Br)Br 34a_100000211012_100009893172 [0,1,1,0,0,0|1,0,0]=3 1976 B14R1.6823 CC(CCO)Nc1ccc(cc1Br)Cl 34a_100000752454_100009893172 [0,1,1,0,0,0|1,0,0]=3 1977 B14R1.6823 CC(CCO)Nc1ccc(cc1Br)F 34a_100000738039_100009893172 [0,1,1,0,0,0|1,0,0]=3 1978 B14R1.6823 CC(CCO)Nc1ccc(cc1Br)O 34a_100012001276_100009893172 [0,1,1,0,0,0|1,0,0]=3 1979 B14R1.6823 CC(CCO)Nc1ccc(cc1Cl)Br 34a_100000211467_100009893172 [0,1,1,0,0,0|1,0,0]=3 1980 B14R1.6823 CC(CCO)Nc1ccc(cc1Cl)Cl 34a_100000185861_100009893172 [0,1,1,0,0,0|1,0,0]=3 1981 B14R1.6823 CC(CCO)Nc1ccc(cc1Cl)F 34a_100000212003_100009893172 [0,1,1,0,0,0|1,0,0]=3 1982 B14R1.6823 CC(CCO)Nc1ccc(cc1Cl)I 34a_100011218065_100009893172 [0,1,1,0,0,0|1,0,0]=3 1983 B14R1.6823 CC(CCO)Nc1ccc(cc1Cl)O 34a_100011215599_100009893172 [0,1,1,0,0,0|1,0,0]=3 1984 B14R1.6823 CC(CCO)Nc1ccc(cc1F)Br 34a_100000210722_100009893172 [0,1,1,0,0,0|1,0,0]=3 1985 B14R1.6823 CC(CCO)Nc1ccc(cc1F)Cl 34a_100000211020_100009893172 [0,1,1,0,0,0|1,0,0]=3 1986 B14R1.6823 CC(CCO)Nc1ccc(cc1F)F 34a_100000210720_100009893172 [0,1,1,0,0,0|1,0,0]=3 1987 B14R1.6823 CC(CCO)Nc1ccc(cc1F)I 34a_100011215594_100009893172 [0,1,1,0,0,0|1,0,0]=3 1988 B14R1.6823 CC(CCO)Nc1ccc(cc1F)O 34a_100000759473_100009893172 [0,1,1,0,0,0|1,0,0]=3 1989 B14R1.6823 CC(CCO)Nc1ccc(cc1I)Br 34a_100000187925_100009893172 [0,1,1,0,0,0|1,0,0]=3 1990 B14R1.6823 CC(CCO)Nc1ccc(cc1I)Cl 34a_100000761889_100009893172 [0,1,1,0,0,0|1,0,0]=3 1991 B14R1.6823 CC(CCO)Nc1ccc(cc1I)F 34a_100000760547_100009893172 [0,1,1,0,0,0|1,0,0]=3 1992 B14R1.6823 CC(CCO)Nc1ccc(cc1I)O 34a_100010084370_100009893172 [0,1,1,0,0,0|1,0,0]=3 1993 B14R1.6823 CC(CCO)Nc1ccc(cc1O)Br 34a_100000739049_100009893172 [0,1,1,0,0,0|1,0,0]=3 1994 B14R1.6823 CC(CCO)Nc1ccc(cc1O)Cl 34a_100000185728_100009893172 [0,1,1,0,0,0|1,0,0]=3 1995 B14R1.6823 CC(CCO)Nc1ccc(cc1O)F 34a_100000753323_100009893172 [0,1,1,0,0,0|1,0,0]=3 1996 B14R1.6823 CC(CCO)Nc1ccc(cc1O)O 34a_100000106777_100009893172 [0,1,1,0,0,0|1,0,0]=3 1997 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)Br 34a_100000188717_100009893172 [0,1,1,0,0,0|2,0,0]=4 1998 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)Br 7a_100000188717_100009893172 [0,1,1,0,0,0|2,0,0]=4 1999 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)Cl 34a_100000211998_100009893172 [0,1,1,0,0,0|2,0,0]=4 2000 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)Cl 7a_100000211998_100009893172 [0,1,1,0,0,0|2,0,0]=4 2001 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)F 34a_100000211999_100009893172 [0,1,1,0,0,0|2,0,0]=4 2002 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)F 7a_100000211999_100009893172 [0,1,1,0,0,0|2,0,0]=4 2003 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)I 34a_100012361655_100009893172 [0,1,1,0,0,0|2,0,0]=4 2004 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)I 7a_100012361655_100009893172 [0,1,1,0,0,0|2,0,0]=4 2005 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)N 34a_100011534360_100009893172 [0,1,1,0,0,0|2,0,0]=4 2006 B14R1.6823 CC(CCO)Oc1ccc(cc1Br)N 7a_100011534360_100009893172 [0,1,1,0,0,0|2,0,0]=4 2007 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)Br 34a_100000186472_100009893172 [0,1,1,0,0,0|2,0,0]=4 2008 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)Br 7a_100000186472_100009893172 [0,1,1,0,0,0|2,0,0]=4 2009 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)Cl 34a_100015191787_100009893172 [0,1,1,0,0,0|2,0,0]=4 2010 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)Cl 7a_100015191787_100009893172 [0,1,1,0,0,0|2,0,0]=4 2011 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)F 34a_100000212004_100009893172 [0,1,1,0,0,0|2,0,0]=4 2012 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)F 7a_100000212004_100009893172 [0,1,1,0,0,0|2,0,0]=4 2013 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)I 34a_100012360047_100009893172 [0,1,1,0,0,0|2,0,0]=4 2014 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)I 7a_100012360047_100009893172 [0,1,1,0,0,0|2,0,0]=4 2015 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)N 34a_100000744943_100009893172 [0,1,1,0,0,0|2,0,0]=4 2016 B14R1.6823 CC(CCO)Oc1ccc(cc1Cl)N 7a_100000744943_100009893172 [0,1,1,0,0,0|2,0,0]=4 2017 B14R1.6823 CC(CCO)Oc1ccc(cc1F)Br 34a_100000185481_100009893172 [0,1,1,0,0,0|2,0,0]=4 2018 B14R1.6823 CC(CCO)Oc1ccc(cc1F)Br 7a_100000185481_100009893172 [0,1,1,0,0,0|2,0,0]=4 2019 B14R1.6823 CC(CCO)Oc1ccc(cc1F)Cl 34a_100000230166_100009893172 [0,1,1,0,0,0|2,0,0]=4 2020 B14R1.6823 CC(CCO)Oc1ccc(cc1F)Cl 7a_100000230166_100009893172 [0,1,1,0,0,0|2,0,0]=4 2021 B14R1.6823 CC(CCO)Oc1ccc(cc1F)F 34a_100000230127_100009893172 [0,1,1,0,0,0|2,0,0]=4 2022 B14R1.6823 CC(CCO)Oc1ccc(cc1F)F 7a_100000230127_100009893172 [0,1,1,0,0,0|2,0,0]=4 2023 B14R1.6823 CC(CCO)Oc1ccc(cc1F)I 34a_100011356965_100009893172 [0,1,1,0,0,0|2,0,0]=4 2024 B14R1.6823 CC(CCO)Oc1ccc(cc1F)I 7a_100011356965_100009893172 [0,1,1,0,0,0|2,0,0]=4 2025 B14R1.6823 CC(CCO)Oc1ccc(cc1F)N 34a_100011220035_100009893172 [0,1,1,0,0,0|2,0,0]=4 2026 B14R1.6823 CC(CCO)Oc1ccc(cc1F)N 7a_100011220035_100009893172 [0,1,1,0,0,0|2,0,0]=4 2027 B14R1.6823 CC(CCO)Oc1ccc(cc1I)Br 34a_100012355227_100009893172 [0,1,1,0,0,0|2,0,0]=4 2028 B14R1.6823 CC(CCO)Oc1ccc(cc1I)Br 7a_100012355227_100009893172 [0,1,1,0,0,0|2,0,0]=4 2029 B14R1.6823 CC(CCO)Oc1ccc(cc1I)Cl 34a_100011356953_100009893172 [0,1,1,0,0,0|2,0,0]=4 2030 B14R1.6823 CC(CCO)Oc1ccc(cc1I)Cl 7a_100011356953_100009893172 [0,1,1,0,0,0|2,0,0]=4 2031 B14R1.6823 CC(CCO)Oc1ccc(cc1I)F 34a_100012355409_100009893172 [0,1,1,0,0,0|2,0,0]=4 2032 B14R1.6823 CC(CCO)Oc1ccc(cc1I)F 7a_100012355409_100009893172 [0,1,1,0,0,0|2,0,0]=4 2033 B14R1.6823 CC(CCO)Oc1ccc(cc1I)I 7a_100010001573_100009893172 [0,1,1,0,0,0|2,0,0]=4 2034 B14R1.6823 CC(CCO)Oc1ccc(cc1N)Br 34a_100000752626_100009893172 [0,1,1,0,0,0|2,0,0]=4 2035 B14R1.6823 CC(CCO)Oc1ccc(cc1N)Br 7a_100000752626_100009893172 [0,1,1,0,0,0|2,0,0]=4 2036 B14R1.6823 CC(CCO)Oc1ccc(cc1N)Cl 34a_100000210500_100009893172 [0,1,1,0,0,0|2,0,0]=4 2037 B14R1.6823 CC(CCO)Oc1ccc(cc1N)Cl 7a_100000210500_100009893172 [0,1,1,0,0,0|2,0,0]=4 2038 B14R1.6823 CC(CCO)Oc1ccc(cc1N)F 34a_100000759472_100009893172 [0,1,1,0,0,0|2,0,0]=4 2039 B14R1.6823 CC(CCO)Oc1ccc(cc1N)F 7a_100000759472_100009893172 [0,1,1,0,0,0|2,0,0]=4 2040 B14R1.6823 CC(CCO)Oc1ccc(cc1N)I 34a_100000753495_100009893172 [0,1,1,0,0,0|2,0,0]=4 2041 B14R1.6823 CC(CCO)Oc1ccc(cc1N)I 7a_100000753495_100009893172 [0,1,1,0,0,0|2,0,0]=4 2042 B14R1.6823 CC(CCO)Oc1ccc(cc1N)N 34a_100000725306_100009893172 [0,1,1,0,0,0|2,0,0]=4 2043 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)Br 62a_100009893172_100011484698 [0,1,1,0,0,0|2,0,0]=4 2044 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)Br 62a_100011484698_100009893172 [0,1,1,0,0,0|2,0,0]=4 2045 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)Cl 62a_100009893172_100011219703 [0,1,1,0,0,0|2,0,0]=4 2046 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)Cl 62a_100011219703_100009893172 [0,1,1,0,0,0|2,0,0]=4 2047 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)F 62a_100009893172_100011217111 [0,1,1,0,0,0|2,0,0]=4 2048 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)F 62a_100011217111_100009893172 [0,1,1,0,0,0|2,0,0]=4 2049 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)N 62a_100000750458_100009893172 [0,1,1,0,0,0|2,0,0]=4 2050 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)N 62a_100009893172_100000750458 [0,1,1,0,0,0|2,0,0]=4 2051 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)O 62a_100000701344_100009893172 [0,1,1,0,0,0|2,0,0]=4 2052 B14R1.6823 CC(CCO)Sc1ccc(cc1Br)O 62a_100009893172_100000701344 [0,1,1,0,0,0|2,0,0]=4 2053 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)Br 62a_100009893172_100011216062 [0,1,1,0,0,0|2,0,0]=4 2054 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)Br 62a_100011216062_100009893172 [0,1,1,0,0,0|2,0,0]=4 2055 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)Cl 62a_100000699841_100009893172 [0,1,1,0,0,0|2,0,0]=4 2056 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)Cl 62a_100009893172_100000699841 [0,1,1,0,0,0|2,0,0]=4 2057 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)F 62a_100000733362_100009893172 [0,1,1,0,0,0|2,0,0]=4 2058 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)F 62a_100009893172_100000733362 [0,1,1,0,0,0|2,0,0]=4 2059 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)N 62a_100000761885_100009893172 [0,1,1,0,0,0|2,0,0]=4 2060 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)N 62a_100009893172_100000761885 [0,1,1,0,0,0|2,0,0]=4 2061 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)O 62a_100000047559_100009893172 [0,1,1,0,0,0|2,0,0]=4 2062 B14R1.6823 CC(CCO)Sc1ccc(cc1Cl)O 62a_100009893172_100000047559 [0,1,1,0,0,0|2,0,0]=4 2063 B14R1.6823 CC(CCO)Sc1ccc(cc1F)Br 62a_100009814013_100009893172 [0,1,1,0,0,0|2,0,0]=4 2064 B14R1.6823 CC(CCO)Sc1ccc(cc1F)Br 62a_100009893172_100009814013 [0,1,1,0,0,0|2,0,0]=4 2065 B14R1.6823 CC(CCO)Sc1ccc(cc1F)Cl 62a_100009893172_100011216042 [0,1,1,0,0,0|2,0,0]=4 2066 B14R1.6823 CC(CCO)Sc1ccc(cc1F)Cl 62a_100011216042_100009893172 [0,1,1,0,0,0|2,0,0]=4 2067 B14R1.6823 CC(CCO)Sc1ccc(cc1F)F 62a_100000750030_100009893172 [0,1,1,0,0,0|2,0,0]=4 2068 B14R1.6823 CC(CCO)Sc1ccc(cc1F)F 62a_100009893172_100000750030 [0,1,1,0,0,0|2,0,0]=4 2069 B14R1.6823 CC(CCO)Sc1ccc(cc1F)N 62a_100009893172_100011356925 [0,1,1,0,0,0|2,0,0]=4 2070 B14R1.6823 CC(CCO)Sc1ccc(cc1F)N 62a_100011356925_100009893172 [0,1,1,0,0,0|2,0,0]=4 2071 B14R1.6823 CC(CCO)Sc1ccc(cc1F)O 62a_100000755031_100009893172 [0,1,1,0,0,0|2,0,0]=4 2072 B14R1.6823 CC(CCO)Sc1ccc(cc1F)O 62a_100009893172_100000755031 [0,1,1,0,0,0|2,0,0]=4 2073 B14R1.6823 CC(CCO)Sc1ccc(cc1N)Br 62a_100000743836_100009893172 [0,1,1,0,0,0|2,0,0]=4 2074 B14R1.6823 CC(CCO)Sc1ccc(cc1N)Br 62a_100009893172_100000743836 [0,1,1,0,0,0|2,0,0]=4 2075 B14R1.6823 CC(CCO)Sc1ccc(cc1N)Cl 62a_100000761886_100009893172 [0,1,1,0,0,0|2,0,0]=4 2076 B14R1.6823 CC(CCO)Sc1ccc(cc1N)Cl 62a_100009893172_100000761886 [0,1,1,0,0,0|2,0,0]=4 2077 B14R1.6823 CC(CCO)Sc1ccc(cc1N)F 62a_100000687223_100009893172 [0,1,1,0,0,0|2,0,0]=4 2078 B14R1.6823 CC(CCO)Sc1ccc(cc1N)F 62a_100009893172_100000687223 [0,1,1,0,0,0|2,0,0]=4 2079 B14R1.6823 CC(CCO)Sc1ccc(cc1N)N 62a_100009893172_200012175722 [0,1,1,0,0,0|2,0,0]=4 2080 B14R1.6823 CC(CCO)Sc1ccc(cc1N)N 62a_200012175722_100009893172 [0,1,1,0,0,0|2,0,0]=4 2081 B14R1.6823 CC(CCO)Sc1ccc(cc1N)O 62a_100009893172_100011999798 [0,1,1,0,0,0|2,0,0]=4 2082 B14R1.6823 CC(CCO)Sc1ccc(cc1N)O 62a_100011999798_100009893172 [0,1,1,0,0,0|2,0,0]=4 2083 B14R1.6823 CC(CCO)Sc1ccc(cc1O)Br 62a_100009893172_100012344904 [0,1,1,0,0,0|2,0,0]=4 2084 B14R1.6823 CC(CCO)Sc1ccc(cc1O)Br 62a_100012344904_100009893172 [0,1,1,0,0,0|2,0,0]=4 2085 B14R1.6823 CC(CCO)Sc1ccc(cc1O)Cl 62a_100000050036_100009893172 [0,1,1,0,0,0|2,0,0]=4 2086 B14R1.6823 CC(CCO)Sc1ccc(cc1O)Cl 62a_100009893172_100000050036 [0,1,1,0,0,0|2,0,0]=4 2087 B14R1.6823 CC(CCO)Sc1ccc(cc1O)F 62a_100000690578_100009893172 [0,1,1,0,0,0|2,0,0]=4 2088 B14R1.6823 CC(CCO)Sc1ccc(cc1O)F 62a_100009893172_100000690578 [0,1,1,0,0,0|2,0,0]=4 2089 B14R1.6823 CC(CCO)Sc1ccc(cc1O)O 62a_100009893172_100009813921 [0,1,1,0,0,0|2,0,0]=4 2090 B14R1.6823 CCCC(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000766640 [0,1,1,0,0,0|2,0,0]=4 2091 B14R1.6823 CCCC(C)Nc1ccc(cc1Br)C 34a_100000210942_100000766640 [0,1,1,0,0,0|1,0,0]=3 2092 B14R1.6823 CCCC(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000766640 [0,1,1,0,0,0|2,0,0]=4 2093 B14R1.6823 CCCC(C)Nc1ccc(cc1Br)F 34a_100000738039_100000766640 [0,1,1,0,0,0|2,0,0]=4 2094 B14R1.6823 CCCC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000766640 [0,1,1,0,0,0|2,0,0]=4 2095 B14R1.6823 CCCC(C)Nc1ccc(cc1C)Br 34a_100000211769_100000766640 [0,1,1,0,0,0|2,0,0]=4 2096 B14R1.6823 CCCC(C)Nc1ccc(cc1C)Br 7a_100000211769_100000766640 [0,1,1,0,0,0|2,0,0]=4 2097 B14R1.6823 CCCC(C)Nc1ccc(cc1C)C 34a_100000736561_100000766640 [0,1,1,0,0,0|1,0,0]=3 2098 B14R1.6823 CCCC(C)Nc1ccc(cc1C)C 7a_100000736561_100000766640 [0,1,1,0,0,0|1,0,0]=3 2099 B14R1.6823 CCCC(C)Nc1ccc(cc1C)Cl 34a_100000210418_100000766640 [0,1,1,0,0,0|2,0,0]=4 2100 B14R1.6823 CCCC(C)Nc1ccc(cc1C)Cl 7a_100000210418_100000766640 [0,1,1,0,0,0|2,0,0]=4 2101 B14R1.6823 CCCC(C)Nc1ccc(cc1C)F 34a_100000211637_100000766640 [0,1,1,0,0,0|2,0,0]=4 2102 B14R1.6823 CCCC(C)Nc1ccc(cc1C)F 7a_100000211637_100000766640 [0,1,1,0,0,0|2,0,0]=4 2103 B14R1.6823 CCCC(C)Nc1ccc(cc1C)I 34a_100000184554_100000766640 [0,1,1,0,0,0|2,0,0]=4 2104 B14R1.6823 CCCC(C)Nc1ccc(cc1C)I 7a_100000184554_100000766640 [0,1,1,0,0,0|2,0,0]=4 2105 B14R1.6823 CCCC(C)Nc1ccc(cc1C)O 34a_100000756630_100000766640 [0,1,1,0,0,0|2,0,0]=4 2106 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000766640 [0,1,1,0,0,0|2,0,0]=4 2107 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)C 34a_100000210522_100000766640 [0,1,1,0,0,0|1,0,0]=3 2108 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000766640 [0,1,1,0,0,0|2,0,0]=4 2109 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000766640 [0,1,1,0,0,0|2,0,0]=4 2110 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000766640 [0,1,1,0,0,0|2,0,0]=4 2111 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000766640 [0,1,1,0,0,0|2,0,0]=4 2112 B14R1.6823 CCCC(C)Nc1ccc(cc1F)Br 34a_100000210722_100000766640 [0,1,1,0,0,0|2,0,0]=4 2113 B14R1.6823 CCCC(C)Nc1ccc(cc1F)C 34a_100000211023_100000766640 [0,1,1,0,0,0|1,0,0]=3 2114 B14R1.6823 CCCC(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000766640 [0,1,1,0,0,0|2,0,0]=4 2115 B14R1.6823 CCCC(C)Nc1ccc(cc1F)F 34a_100000210720_100000766640 [0,1,1,0,0,0|2,0,0]=4 2116 B14R1.6823 CCCC(C)Nc1ccc(cc1F)I 34a_100011215594_100000766640 [0,1,1,0,0,0|2,0,0]=4 2117 B14R1.6823 CCCC(C)Nc1ccc(cc1F)O 34a_100000759473_100000766640 [0,1,1,0,0,0|2,0,0]=4 2118 B14R1.6823 CCCC(C)Nc1ccc(cc1I)Br 34a_100000187925_100000766640 [0,1,1,0,0,0|2,0,0]=4 2119 B14R1.6823 CCCC(C)Nc1ccc(cc1I)C 34a_100011356834_100000766640 [0,1,1,0,0,0|1,0,0]=3 2120 B14R1.6823 CCCC(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000766640 [0,1,1,0,0,0|2,0,0]=4 2121 B14R1.6823 CCCC(C)Nc1ccc(cc1I)F 34a_100000760547_100000766640 [0,1,1,0,0,0|2,0,0]=4 2122 B14R1.6823 CCCC(C)Nc1ccc(cc1I)O 34a_100010084370_100000766640 [0,1,1,0,0,0|2,0,0]=4 2123 B14R1.6823 CCCC(C)Nc1ccc(cc1O)Br 34a_100000739049_100000766640 [0,1,1,0,0,0|2,0,0]=4 2124 B14R1.6823 CCCC(C)Nc1ccc(cc1O)C 34a_100000211527_100000766640 [0,1,1,0,0,0|1,0,0]=3 2125 B14R1.6823 CCCC(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000766640 [0,1,1,0,0,0|2,0,0]=4 2126 B14R1.6823 CCCC(C)Nc1ccc(cc1O)F 34a_100000753323_100000766640 [0,1,1,0,0,0|2,0,0]=4 2127 B14R1.6823 CCCC(C)Nc1ccc(cc1O)O 34a_100000106777_100000766640 [0,1,1,0,0,0|2,0,0]=4 2128 B14R1.6823 CCCC(C)Oc1ccc(cc1Br)C 34a_100000210800_100000766640 [0,1,1,0,0,0|2,0,0]=4 2129 B14R1.6823 CCCC(C)Oc1ccc(cc1Br)C 7a_100000210800_100000766640 [0,1,1,0,0,0|2,0,0]=4 2130 B14R1.6823 CCCC(C)Oc1ccc(cc1C)C 34a_100000211776_100000766640 [0,1,1,0,0,0|2,0,0]=4 2131 B14R1.6823 CCCC(C)Oc1ccc(cc1C)C 7a_100000211776_100000766640 [0,1,1,0,0,0|2,0,0]=4 2132 B14R1.6823 CCCC(C)Oc1ccc(cc1Cl)C 34a_100000749699_100000766640 [0,1,1,0,0,0|2,0,0]=4 2133 B14R1.6823 CCCC(C)Oc1ccc(cc1Cl)C 7a_100000749699_100000766640 [0,1,1,0,0,0|2,0,0]=4 2134 B14R1.6823 CCCC(C)Oc1ccc(cc1F)C 34a_100011216688_100000766640 [0,1,1,0,0,0|2,0,0]=4 2135 B14R1.6823 CCCC(C)Oc1ccc(cc1F)C 7a_100011216688_100000766640 [0,1,1,0,0,0|2,0,0]=4 2136 B14R1.6823 CCCC(C)Oc1ccc(cc1I)C 34a_100000765521_100000766640 [0,1,1,0,0,0|2,0,0]=4 2137 B14R1.6823 CCCC(C)Oc1ccc(cc1I)C 7a_100000765521_100000766640 [0,1,1,0,0,0|2,0,0]=4 2138 B14R1.6823 CCCC(C)Oc1ccc(cc1N)C 34a_100011215204_100000766640 [0,1,1,0,0,0|2,0,0]=4 2139 B14R1.6823 CCCC(C)Oc1ccc(cc1N)C 7a_100011215204_100000766640 [0,1,1,0,0,0|2,0,0]=4 2140 B14R1.6823 CCCC(C)Sc1ccc(cc1Br)C 62a_100000766640_100009813563 [0,1,1,0,0,0|2,0,0]=4 2141 B14R1.6823 CCCC(C)Sc1ccc(cc1Br)C 62a_100009813563_100000766640 [0,1,1,0,0,0|2,0,0]=4 2142 B14R1.6823 CCCC(C)Sc1ccc(cc1C)C 62a_100000766640_100011217332 [0,1,1,0,0,0|2,0,0]=4 2143 B14R1.6823 CCCC(C)Sc1ccc(cc1C)C 62a_100011217332_100000766640 [0,1,1,0,0,0|2,0,0]=4 2144 B14R1.6823 CCCC(C)Sc1ccc(cc1Cl)C 62a_100000766640_100011263221 [0,1,1,0,0,0|2,0,0]=4 2145 B14R1.6823 CCCC(C)Sc1ccc(cc1Cl)C 62a_100011263221_100000766640 [0,1,1,0,0,0|2,0,0]=4 2146 B14R1.6823 CCCC(C)Sc1ccc(cc1F)C 62a_100000766640_100011216119 [0,1,1,0,0,0|2,0,0]=4 2147 B14R1.6823 CCCC(C)Sc1ccc(cc1F)C 62a_100011216119_100000766640 [0,1,1,0,0,0|2,0,0]=4 2148 B14R1.6823 CCCC(C)Sc1ccc(cc1N)C 62a_100000766640_100011216686 [0,1,1,0,0,0|2,0,0]=4 2149 B14R1.6823 CCCC(C)Sc1ccc(cc1N)C 62a_100011216686_100000766640 [0,1,1,0,0,0|2,0,0]=4 2150 B14R1.6823 CCCC(C)Sc1ccc(cc1O)C 62a_100000766640_100012002257 [0,1,1,0,0,0|2,0,0]=4 2151 B14R1.6823 CCCC(C)Sc1ccc(cc1O)C 62a_100012002257_100000766640 [0,1,1,0,0,0|2,0,0]=4 2152 B14R1.6823 COCC(C)Nc1ccc(cc1Br)C 34a_100000210942_100000765312 [0,1,1,0,0,0|2,0,0]=4 2153 B14R1.6823 COCC(C)Nc1ccc(cc1C)C 34a_100000736561_100000765312 [0,1,1,0,0,0|2,0,0]=4 2154 B14R1.6823 COCC(C)Nc1ccc(cc1C)C 7a_100000736561_100000765312 [0,1,1,0,0,0|2,0,0]=4 2155 B14R1.6823 COCC(C)Nc1ccc(cc1Cl)C 34a_100000210522_100000765312 [0,1,1,0,0,0|2,0,0]=4 2156 B14R1.6823 COCC(C)Nc1ccc(cc1F)C 34a_100000211023_100000765312 [0,1,1,0,0,0|2,0,0]=4 2157 B14R1.6823 COCC(C)Nc1ccc(cc1I)C 34a_100011356834_100000765312 [0,1,1,0,0,0|2,0,0]=4 2158 B14R1.6823 COCC(C)Nc1ccc(cc1O)C 34a_100000211527_100000765312 [0,1,1,0,0,0|2,0,0]=4 2159 B14R1.6823 Cc1cc(=O)c(co1)OC(C)CCO 34a_100000081520_100009893172 [0,1,1,0,0,0|2,0,0]=4 2160 B14R1.6823 Cc1cc(c(cn1)OC(C)CCO)Br 34a_100009843476_100009893172 [0,1,1,0,0,0|2,0,0]=4 2161 B14R1.6823 Cc1cc(c(cn1)OC(C)CCO)Br 7a_100009843476_100009893172 [0,1,1,0,0,0|2,0,0]=4 2162 B14R1.6823 Cc1cc(c(cn1)OC(C)CCO)C 34a_200000068632_100009893172 [0,1,1,0,0,0|2,0,0]=4 2163 B14R1.6823 Cc1cc(c(cn1)OC(C)CCO)C 7a_200000068632_100009893172 [0,1,1,0,0,0|2,0,0]=4 2164 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)C 62a_100009819613_100009893172 [0,1,1,0,0,0|2,0,0]=4 2165 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)C 62a_100009893172_100009819613 [0,1,1,0,0,0|2,0,0]=4 2166 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)N 62a_100009817891_100009893172 [0,1,1,0,0,0|2,0,0]=4 2167 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)N 62a_100009893172_100009817891 [0,1,1,0,0,0|2,0,0]=4 2168 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)O 62a_100009893172_100011016184 [0,1,1,0,0,0|2,0,0]=4 2169 B14R1.6823 Cc1cc(c(cn1)SC(C)CCO)O 62a_100011016184_100009893172 [0,1,1,0,0,0|2,0,0]=4 2170 B14R1.6823 Cc1cc(ccc1NC(C)CCO)Br 34a_100000211769_100009893172 [0,1,1,0,0,0|1,0,0]=3 2171 B14R1.6823 Cc1cc(ccc1NC(C)CCO)Br 7a_100000211769_100009893172 [0,1,1,0,0,0|1,0,0]=3 2172 B14R1.6823 Cc1cc(ccc1NC(C)CCO)Cl 34a_100000210418_100009893172 [0,1,1,0,0,0|1,0,0]=3 2173 B14R1.6823 Cc1cc(ccc1NC(C)CCO)Cl 7a_100000210418_100009893172 [0,1,1,0,0,0|1,0,0]=3 2174 B14R1.6823 Cc1cc(ccc1NC(C)CCO)F 34a_100000211637_100009893172 [0,1,1,0,0,0|1,0,0]=3 2175 B14R1.6823 Cc1cc(ccc1NC(C)CCO)F 7a_100000211637_100009893172 [0,1,1,0,0,0|1,0,0]=3 2176 B14R1.6823 Cc1cc(ccc1NC(C)CCO)I 34a_100000184554_100009893172 [0,1,1,0,0,0|1,0,0]=3 2177 B14R1.6823 Cc1cc(ccc1NC(C)CCO)I 7a_100000184554_100009893172 [0,1,1,0,0,0|1,0,0]=3 2178 B14R1.6823 Cc1cc(ccc1NC(C)CCO)O 34a_100000756630_100009893172 [0,1,1,0,0,0|1,0,0]=3 2179 B14R1.6823 Cc1cc(ccc1OC(C)CCO)Br 34a_100000186361_100009893172 [0,1,1,0,0,0|2,0,0]=4 2180 B14R1.6823 Cc1cc(ccc1OC(C)CCO)Br 7a_100000186361_100009893172 [0,1,1,0,0,0|2,0,0]=4 2181 B14R1.6823 Cc1cc(ccc1OC(C)CCO)Cl 34a_100000211091_100009893172 [0,1,1,0,0,0|2,0,0]=4 2182 B14R1.6823 Cc1cc(ccc1OC(C)CCO)Cl 7a_100000211091_100009893172 [0,1,1,0,0,0|2,0,0]=4 2183 B14R1.6823 Cc1cc(ccc1OC(C)CCO)F 34a_100000764316_100009893172 [0,1,1,0,0,0|2,0,0]=4 2184 B14R1.6823 Cc1cc(ccc1OC(C)CCO)F 7a_100000764316_100009893172 [0,1,1,0,0,0|2,0,0]=4 2185 B14R1.6823 Cc1cc(ccc1OC(C)CCO)I 34a_100011218673_100009893172 [0,1,1,0,0,0|2,0,0]=4 2186 B14R1.6823 Cc1cc(ccc1OC(C)CCO)I 7a_100011218673_100009893172 [0,1,1,0,0,0|2,0,0]=4 2187 B14R1.6823 Cc1cc(ccc1OC(C)CCO)N 34a_100011218179_100009893172 [0,1,1,0,0,0|2,0,0]=4 2188 B14R1.6823 Cc1cc(ccc1OC(C)CCO)N 7a_100011218179_100009893172 [0,1,1,0,0,0|2,0,0]=4 2189 B14R1.6823 Cc1cc(ccc1SC(C)CCO)Br 62a_100000701812_100009893172 [0,1,1,0,0,0|2,0,0]=4 2190 B14R1.6823 Cc1cc(ccc1SC(C)CCO)Br 62a_100009893172_100000701812 [0,1,1,0,0,0|2,0,0]=4 2191 B14R1.6823 Cc1cc(ccc1SC(C)CCO)Cl 62a_100009893172_100011219607 [0,1,1,0,0,0|2,0,0]=4 2192 B14R1.6823 Cc1cc(ccc1SC(C)CCO)Cl 62a_100011219607_100009893172 [0,1,1,0,0,0|2,0,0]=4 2193 B14R1.6823 Cc1cc(ccc1SC(C)CCO)F 62a_100009893172_100011205405 [0,1,1,0,0,0|2,0,0]=4 2194 B14R1.6823 Cc1cc(ccc1SC(C)CCO)F 62a_100011205405_100009893172 [0,1,1,0,0,0|2,0,0]=4 2195 B14R1.6823 Cc1cc(ccc1SC(C)CCO)N 62a_100000210723_100009893172 [0,1,1,0,0,0|2,0,0]=4 2196 B14R1.6823 Cc1cc(ccc1SC(C)CCO)N 62a_100009893172_100000210723 [0,1,1,0,0,0|2,0,0]=4 2197 B14R1.6823 Cc1cc(ccc1SC(C)CCO)O 62a_100009893172_100000690111 [0,1,1,0,0,0|2,0,0]=4 2198 B14R1.6823 Cc1ccc([n+](c1)[O-])SC(C)CCO 62a_100009893172_100009819918 [0,1,1,0,0,0|2,0,0]=4 2199 B14R1.6823 Cc1ccc(c(c1)Br)CN(C)CCO 26a_100000210263_100000210800 [0,1,1,0,0,0|2,0,0]=4 2200 B14R1.6823 Cc1ccc(c(c1)Br)CN(C)CCO 270004a_100000210263_100000692596 [0,1,1,0,0,0|2,0,0]=4 2201 B14R1.6823 Cc1ccc(c(c1)Br)NC(C)CCO 34a_100000210942_100009893172 [0,1,1,0,0,0|0,0,0]=2 2202 B14R1.6823 Cc1ccc(c(c1)Br)OC(C)CCO 34a_100000210800_100009893172 [0,1,1,0,0,0|1,0,0]=3 2203 B14R1.6823 Cc1ccc(c(c1)Br)OC(C)CCO 7a_100000210800_100009893172 [0,1,1,0,0,0|1,0,0]=3 2204 B14R1.6823 Cc1ccc(c(c1)Br)SC(C)CCO 62a_100009813563_100009893172 [0,1,1,0,0,0|1,0,0]=3 2205 B14R1.6823 Cc1ccc(c(c1)Br)SC(C)CCO 62a_100009893172_100009813563 [0,1,1,0,0,0|1,0,0]=3 2206 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 2230a_100000210263_100011219618 [0,1,1,0,0,0|2,0,0]=4 2207 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 2230a_100025771030_100000211926 [0,1,1,0,0,0|2,0,0]=4 2208 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 269982a_100000210263_100011219618 [0,1,1,0,0,0|2,0,0]=4 2209 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 269982a_100025771030_100000211926 [0,1,1,0,0,0|2,0,0]=4 2210 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 270004a_100000210263_100000211342 [0,1,1,0,0,0|2,0,0]=4 2211 B14R1.6823 Cc1ccc(c(c1)C)CN(C)CCO 34a_100025771030_100000211926 [0,1,1,0,0,0|2,0,0]=4 2212 B14R1.6823 Cc1ccc(c(c1)C)NC(=O)CCO 22a_100000736561_100011216618 [0,1,1,0,0,0|1,0,1]=4 2213 B14R1.6823 Cc1ccc(c(c1)C)NC(C)CC#N 7a_100000736561_100009813641 [0,1,1,0,0,0|1,0,1]=4 2214 B14R1.6823 Cc1ccc(c(c1)C)NC(C)CCO 34a_100000736561_100009893172 [0,1,1,0,0,0|0,0,0]=2 2215 B14R1.6823 Cc1ccc(c(c1)C)NC(C)CCO 7a_100000736561_100009893172 [0,1,1,0,0,0|0,0,0]=2 2216 B14R1.6823 Cc1ccc(c(c1)C)OC(C)CCO 34a_100000211776_100009893172 [0,1,1,0,0,0|1,0,0]=3 2217 B14R1.6823 Cc1ccc(c(c1)C)OC(C)CCO 7a_100000211776_100009893172 [0,1,1,0,0,0|1,0,0]=3 2218 B14R1.6823 Cc1ccc(c(c1)C)SC(C)CCO 62a_100009893172_100011217332 [0,1,1,0,0,0|1,0,0]=3 2219 B14R1.6823 Cc1ccc(c(c1)C)SC(C)CCO 62a_100011217332_100009893172 [0,1,1,0,0,0|1,0,0]=3 2220 B14R1.6823 Cc1ccc(c(c1)Cl)CN(C)CCO 2230a_100000210263_100012349684 [0,1,1,0,0,0|2,0,0]=4 2221 B14R1.6823 Cc1ccc(c(c1)Cl)CN(C)CCO 269982a_100000210263_100012349684 [0,1,1,0,0,0|2,0,0]=4 2222 B14R1.6823 Cc1ccc(c(c1)Cl)CN(C)CCO 26a_100000210263_100000749699 [0,1,1,0,0,0|2,0,0]=4 2223 B14R1.6823 Cc1ccc(c(c1)Cl)CN(C)CCO 270004a_100000210263_100011935181 [0,1,1,0,0,0|2,0,0]=4 2224 B14R1.6823 Cc1ccc(c(c1)Cl)NC(=O)CCO 22a_100000210522_100011216618 [0,1,1,0,0,0|1,0,1]=4 2225 B14R1.6823 Cc1ccc(c(c1)Cl)NC(C)CCO 34a_100000210522_100009893172 [0,1,1,0,0,0|0,0,0]=2 2226 B14R1.6823 Cc1ccc(c(c1)Cl)OC(C)CCO 34a_100000749699_100009893172 [0,1,1,0,0,0|1,0,0]=3 2227 B14R1.6823 Cc1ccc(c(c1)Cl)OC(C)CCO 7a_100000749699_100009893172 [0,1,1,0,0,0|1,0,0]=3 2228 B14R1.6823 Cc1ccc(c(c1)Cl)SC(C)CCO 62a_100009893172_100011263221 [0,1,1,0,0,0|1,0,0]=3 2229 B14R1.6823 Cc1ccc(c(c1)Cl)SC(C)CCO 62a_100011263221_100009893172 [0,1,1,0,0,0|1,0,0]=3 2230 B14R1.6823 Cc1ccc(c(c1)F)CN(C)CCO 2230a_100000210263_100011217900 [0,1,1,0,0,0|2,0,0]=4 2231 B14R1.6823 Cc1ccc(c(c1)F)CN(C)CCO 269982a_100000210263_100011217900 [0,1,1,0,0,0|2,0,0]=4 2232 B14R1.6823 Cc1ccc(c(c1)F)CN(C)CCO 270004a_100000210263_100011217368 [0,1,1,0,0,0|2,0,0]=4 2233 B14R1.6823 Cc1ccc(c(c1)F)NC(=O)CCO 22a_100000211023_100011216618 [0,1,1,0,0,0|1,0,1]=4 2234 B14R1.6823 Cc1ccc(c(c1)F)NC(C)CCO 34a_100000211023_100009893172 [0,1,1,0,0,0|0,0,0]=2 2235 B14R1.6823 Cc1ccc(c(c1)F)OC(C)CCO 34a_100011216688_100009893172 [0,1,1,0,0,0|1,0,0]=3 2236 B14R1.6823 Cc1ccc(c(c1)F)OC(C)CCO 7a_100011216688_100009893172 [0,1,1,0,0,0|1,0,0]=3 2237 B14R1.6823 Cc1ccc(c(c1)F)SC(C)CCO 62a_100009893172_100011216119 [0,1,1,0,0,0|1,0,0]=3 2238 B14R1.6823 Cc1ccc(c(c1)F)SC(C)CCO 62a_100011216119_100009893172 [0,1,1,0,0,0|1,0,0]=3 2239 B14R1.6823 Cc1ccc(c(c1)I)CN(C)CCO 270004a_100000210263_100010150104 [0,1,1,0,0,0|2,0,0]=4 2240 B14R1.6823 Cc1ccc(c(c1)I)NC(C)CCO 34a_100011356834_100009893172 [0,1,1,0,0,0|0,0,0]=2 2241 B14R1.6823 Cc1ccc(c(c1)I)OC(C)CCO 34a_100000765521_100009893172 [0,1,1,0,0,0|1,0,0]=3 2242 B14R1.6823 Cc1ccc(c(c1)I)OC(C)CCO 7a_100000765521_100009893172 [0,1,1,0,0,0|1,0,0]=3 2243 B14R1.6823 Cc1ccc(c(c1)N)OC(C)CCO 34a_100011215204_100009893172 [0,1,1,0,0,0|1,0,0]=3 2244 B14R1.6823 Cc1ccc(c(c1)N)OC(C)CCO 7a_100011215204_100009893172 [0,1,1,0,0,0|1,0,0]=3 2245 B14R1.6823 Cc1ccc(c(c1)N)SC(C)CCO 62a_100009893172_100011216686 [0,1,1,0,0,0|1,0,0]=3 2246 B14R1.6823 Cc1ccc(c(c1)N)SC(C)CCO 62a_100011216686_100009893172 [0,1,1,0,0,0|1,0,0]=3 2247 B14R1.6823 Cc1ccc(c(c1)O)NC(=O)CCO 22a_100000211527_100011216618 [0,1,1,0,0,0|1,0,1]=4 2248 B14R1.6823 Cc1ccc(c(c1)O)NC(C)CCO 34a_100000211527_100009893172 [0,1,1,0,0,0|0,0,0]=2 2249 B14R1.6823 Cc1ccc(c(c1)O)SC(C)CCO 62a_100009893172_100012002257 [0,1,1,0,0,0|1,0,0]=3 2250 B14R1.6823 Cc1ccc(c(c1)O)SC(C)CCO 62a_100012002257_100009893172 [0,1,1,0,0,0|1,0,0]=3 2251 B14R1.6823 Cc1ccc(c(n1)Br)OC(C)CCO 34a_100000702858_100009893172 [0,1,1,0,0,0|2,0,0]=4 2252 B14R1.6823 Cc1ccc(c(n1)Br)OC(C)CCO 7a_100000702858_100009893172 [0,1,1,0,0,0|2,0,0]=4 2253 B14R1.6823 Cc1ccc(c(n1)C)OC(C)CCO 34a_100011218912_100009893172 [0,1,1,0,0,0|2,0,0]=4 2254 B14R1.6823 Cc1ccc(c(n1)C)OC(C)CCO 7a_100011218912_100009893172 [0,1,1,0,0,0|2,0,0]=4 2255 B14R1.6823 Cc1ccc(c(n1)C)SC(C)CCO 62a_100009813853_100009893172 [0,1,1,0,0,0|2,0,0]=4 2256 B14R1.6823 Cc1ccc(c(n1)C)SC(C)CCO 62a_100009893172_100009813853 [0,1,1,0,0,0|2,0,0]=4 2257 B14R1.6823 Cc1ccc(c(n1)Cl)OC(C)CCO 34a_100000086286_100009893172 [0,1,1,0,0,0|2,0,0]=4 2258 B14R1.6823 Cc1ccc(c(n1)Cl)OC(C)CCO 7a_100000086286_100009893172 [0,1,1,0,0,0|2,0,0]=4 2259 B14R1.6823 Cc1ccc(c(n1)F)OC(C)CCO 34a_100000079963_100009893172 [0,1,1,0,0,0|2,0,0]=4 2260 B14R1.6823 Cc1ccc(c(n1)F)OC(C)CCO 7a_100000079963_100009893172 [0,1,1,0,0,0|2,0,0]=4 2261 B14R1.6823 Cc1ccc(c(n1)F)SC(C)CCO 62a_100009893172_100010006597 [0,1,1,0,0,0|2,0,0]=4 2262 B14R1.6823 Cc1ccc(c(n1)F)SC(C)CCO 62a_100010006597_100009893172 [0,1,1,0,0,0|2,0,0]=4 2263 B14R1.6823 Cc1ccc(c(n1)I)OC(C)CCO 34a_100000023897_100009893172 [0,1,1,0,0,0|2,0,0]=4 2264 B14R1.6823 Cc1ccc(c(n1)I)OC(C)CCO 7a_100000023897_100009893172 [0,1,1,0,0,0|2,0,0]=4 2265 B14R1.6823 Cc1ccc(c(n1)N)OC(C)CCO 34a_100000694039_100009893172 [0,1,1,0,0,0|2,0,0]=4 2266 B14R1.6823 Cc1ccc(c(n1)N)OC(C)CCO 7a_100000694039_100009893172 [0,1,1,0,0,0|2,0,0]=4 2267 B14R1.6823 Cc1ccc(c(n1)N)SC(C)CCO 62a_100009816662_100009893172 [0,1,1,0,0,0|2,0,0]=4 2268 B14R1.6823 Cc1ccc(c(n1)N)SC(C)CCO 62a_100009893172_100009816662 [0,1,1,0,0,0|2,0,0]=4 2269 B14R1.6823 Cc1ccc(c(n1)O)SC(C)CCO 62a_100009817604_100009893172 [0,1,1,0,0,0|2,0,0]=4 2270 B14R1.6823 Cc1ccc(c(n1)O)SC(C)CCO 62a_100009893172_100009817604 [0,1,1,0,0,0|2,0,0]=4 2271 B14R1.6823 Cc1cnc(c(c1)Br)OC(C)CCO 34a_100000719714_100009893172 [0,1,1,0,0,0|2,0,0]=4 2272 B14R1.6823 Cc1cnc(c(c1)C)SC(C)CCO 62a_100009864548_100009893172 [0,1,1,0,0,0|2,0,0]=4 2273 B14R1.6823 Cc1cnc(c(c1)C)SC(C)CCO 62a_100009893172_100009864548 [0,1,1,0,0,0|2,0,0]=4 2274 B14R1.6823 Cc1cnc(c(c1)F)SC(C)CCO 62a_100009819633_100009893172 [0,1,1,0,0,0|2,0,0]=4 2275 B14R1.6823 Cc1cnc(c(c1)F)SC(C)CCO 62a_100009893172_100009819633 [0,1,1,0,0,0|2,0,0]=4 2276 B14R1.6823 Cc1cnc(c(c1)N)OC(C)CCO 34a_100012000488_100009893172 [0,1,1,0,0,0|2,0,0]=4 2277 B14R1.6823 Cc1cnc(c(c1)N)SC(C)CCO 62a_100000733613_100009893172 [0,1,1,0,0,0|2,0,0]=4 2278 B14R1.6823 Cc1cnc(c(c1)N)SC(C)CCO 62a_100009893172_100000733613 [0,1,1,0,0,0|2,0,0]=4 2279 B14R1.6823 Cc1cnc(c(c1)O)SC(C)CCO 62a_100009893172_100012000487 [0,1,1,0,0,0|2,0,0]=4 2280 B14R1.101 CC(C)Nc1ccc(cc1CO)C#N 27a_100138425928_100010246249 [0,1,1,0,0,0|0,0,1]=3 2281 B14R1.101 CC(C)Sc1ccc(cc1CO)C#N 62a_100000210206_100010246249 [0,1,1,0,0,0|1,0,1]=4 2282 B14R1.101 CC(C)Sc1ccc(cc1CO)C=O 62a_100000210206_100015639582 [0,1,1,0,0,0|1,0,1]=4 2283 B14R1.101 CC(C)Sc1ccc(cc1CO)C=O 62a_100015639582_100000210206 [0,1,1,0,0,0|1,0,1]=4 2284 B14R1.101 CCc1cc(ccc1NC(C)C)C#N 27a_100138425928_100010115944 [0,1,1,0,0,0|1,0,1]=4 2285 B14R1.101 CCc1cc(ccc1NC(C)C)C#N 34a_100011219738_100000210206 [0,1,1,0,0,0|1,0,1]=4 2286 B14R1.101 CCc1cc(ccc1NC(C)C)C#N 7a_100011219738_100000210206 [0,1,1,0,0,0|1,0,1]=4 2287 B14R1.101 CCc1cc(ccc1SC(C)C)OC 62a_100000210206_100000720562 [0,1,1,0,0,0|2,0,0]=4 2288 B14R1.101 CCc1cc(ccc1SC(C)C)OC 62a_100000720562_100000210206 [0,1,1,0,0,0|2,0,0]=4 2289 B14R1.101 COc1cc(c(cn1)SC(C)C)CO 62a_100000210206_100012343675 [0,1,1,0,0,0|2,0,0]=4 2290 B14R1.101 COc1cc(c(cn1)SC(C)C)CO 62a_100012343675_100000210206 [0,1,1,0,0,0|2,0,0]=4 2291 B14R1.101 COc1cc(ccc1NC(C)C)CO 2230a_100000087641_100000210206 [0,1,1,0,0,0|2,0,0]=4 2292 B14R1.101 COc1cc(ccc1NC(C)C)CO 34a_100000087641_100000210206 [0,1,1,0,0,0|2,0,0]=4 2293 B14R1.101 COc1cc(ccc1NC(C)C)SC 2230a_100000766855_100000210206 [0,1,1,0,0,0|2,0,0]=4 2294 B14R1.101 COc1cc(ccc1NC(C)C)SC 34a_100000766855_100000210206 [0,1,1,0,0,0|2,0,0]=4 2295 B14R1.101 COc1ccc(c(c1)C#N)NC(C)C 34a_100011997231_100000210206 [0,1,1,0,0,0|1,0,1]=4 2296 B14R1.101 COc1ccc(c(c1)CN)SC(C)C 62a_100000210206_100000741592 [0,1,1,0,0,0|2,0,0]=4 2297 B14R1.101 COc1ccc(c(c1)CN)SC(C)C 62a_100000741592_100000210206 [0,1,1,0,0,0|2,0,0]=4 2298 B14R1.101 COc1ccc(c(c1)CO)C=C(C)C 271570a_100102525489_200011273942 [0,1,1,0,0,0|1,0,1]=4 2299 B14R1.101 COc1ccc(c(c1)CO)NC(=O)C 22a_100012001277_100000070787 [0,1,1,0,0,0|1,0,1]=4 2300 B14R1.101 COc1ccc(c(c1)CO)NC(=O)C 527a_100012001277_100103153847 [0,1,1,0,0,0|1,0,1]=4 2301 B14R1.101 COc1ccc(c(c1)CO)NC(C)C 34a_100012001277_100000210206 [0,1,1,0,0,0|0,0,0]=2 2302 B14R1.101 COc1ccc(c(c1)CO)SC(C)C 62a_100000210206_200011273942 [0,1,1,0,0,0|1,0,0]=3 2303 B14R1.101 COc1ccc(c(c1)CO)SC(C)C 62a_200011273942_100000210206 [0,1,1,0,0,0|1,0,0]=3 2304 B14R1.101 COc1ccc(c(c1)OC)NC(C)C 2230a_100000211191_100000210206 [0,1,1,0,0,0|2,0,0]=4 2305 B14R1.101 COc1ccc(c(c1)OC)NC(C)C 34a_100000211191_100000210206 [0,1,1,0,0,0|2,0,0]=4 2306 B14R1.101 COc1ccc(c(n1)CO)SC(C)C 62a_100000210206_100010069746 [0,1,1,0,0,0|2,0,0]=4 2307 B14R1.101 COc1ccc(c(n1)CO)SC(C)C 62a_100010069746_100000210206 [0,1,1,0,0,0|2,0,0]=4 2308 B14R1.368 CC(C)Nc1c(cc(cc1CO)F)Br 34a_200010775858_100000210206 [0,1,1,0,0,0|1,0,0]=3 2309 B14R1.368 CC(C)Oc1c(cc(cc1CO)Cl)Br 34a_100009812756_100000210206 [0,1,1,0,0,0|2,0,0]=4 2310 B14R1.368 CC(C)Oc1c(cc(cc1CO)Cl)Br 7a_100009812756_100000210206 [0,1,1,0,0,0|2,0,0]=4 2311 B14R1.368 CCc1cc(cc(c1NC(C)C)Br)Br 34a_200012361292_100000210206 [0,1,1,0,0,0|2,0,0]=4 2312 B14R1.368 CCc1cc(cc(c1NC(C)C)Br)Br 7a_200012361292_100000210206 [0,1,1,0,0,0|2,0,0]=4 2313 B14R1.368 CCc1cc(cc(c1NC(C)C)C)Br 2230a_200000186424_100000210206 [0,1,1,0,0,0|2,0,0]=4 2314 B14R1.368 CCc1cc(cc(c1NC(C)C)C)Br 34a_200000186424_100000210206 [0,1,1,0,0,0|2,0,0]=4 2315 B14R1.368 CCc1cc(cc(c1NC(C)C)C)Br 7a_200000186424_100000210206 [0,1,1,0,0,0|2,0,0]=4 2316 B14R1.438 CC(C)Nc1ccc(cc1CC#N)Br 2230a_100010188562_100000210206 [0,1,1,0,0,0|2,0,0]=4 2317 B14R1.438 CC(C)Nc1ccc(cc1CC#N)Br 7a_100010188562_100000210206 [0,1,1,0,0,0|2,0,0]=4 2318 B14R1.438 CCNc1cc(ccc1OC(C)C)C 2230a_200103155816_100000210202 [0,1,1,0,0,0|2,0,0]=4 2319 B14R1.438 CCNc1cc(ccc1OC(C)C)C 34a_200103155816_100000210202 [0,1,1,0,0,0|2,0,0]=4 2320 B14R1.438 CCNc1cc(ccc1OC(C)C)C 7a_200103155816_100000210202 [0,1,1,0,0,0|2,0,0]=4 2321 B14R1.438 CCOc1cc(ccc1NC(C)C)Br 2230a_100000688918_100000210206 [0,1,1,0,0,0|2,0,0]=4 2322 B14R1.438 CCOc1cc(ccc1NC(C)C)Br 34a_100000688918_100000210206 [0,1,1,0,0,0|2,0,0]=4 2323 B14R1.438 CCOc1cc(ccc1NC(C)C)C 2230a_100000742043_100000210206 [0,1,1,0,0,0|1,0,0]=3 2324 B14R1.438 CCOc1cc(ccc1NC(C)C)C 34a_100000742043_100000210206 [0,1,1,0,0,0|1,0,0]=3 2325 B14R1.438 CCOc1cc(ccc1NC(C)C)Cl 34a_100000687649_100000210206 [0,1,1,0,0,0|2,0,0]=4 2326 B14R1.438 CCOc1cc(ccc1NC(C)C)F 2230a_100000741351_100000210206 [0,1,1,0,0,0|2,0,0]=4 2327 B14R1.438 CCOc1cc(ccc1NC(C)C)F 34a_100000741351_100000210206 [0,1,1,0,0,0|2,0,0]=4 2328 B14R1.438 CCOc1cc(ccc1OC(C)C)C 34a_200000034294_100000210206 [0,1,1,0,0,0|2,0,0]=4 2329 B14R1.438 CCOc1cc(ccc1OC(C)C)C 7a_200000034294_100000210206 [0,1,1,0,0,0|2,0,0]=4 2330 B14R1.438 CCOc1cc(ccc1SC(C)C)C 62a_100000210206_200010713166 [0,1,1,0,0,0|2,0,0]=4 2331 B14R1.438 CCOc1cc(ccc1SC(C)C)C 62a_200010713166_100000210206 [0,1,1,0,0,0|2,0,0]=4 2332 B14R1.438 CNCc1cc(ccc1OC(C)C)C 207a_100102657272_200011845998 [0,1,1,0,0,0|2,0,0]=4 2333 B14R1.438 CNCc1cc(ccc1OC(C)C)C 270004a_106832991635_200011845998 [0,1,1,0,0,0|2,0,0]=4 2334 B14R1.438 COCc1cc(ccc1OC(C)C)F 34a_100135391359_100000210206 [0,1,1,0,0,0|2,0,0]=4 2335 B14R1.438 COCc1cc(ccc1OC(C)C)F 7a_100135391359_100000210206 [0,1,1,0,0,0|2,0,0]=4 2336 B14R1.438 Cc1ccc(c(c1)CC#N)SC(C)C 62a_100000210206_100010147026 [0,1,1,0,0,0|2,0,0]=4 2337 B14R1.438 Cc1ccc(c(c1)CC#N)SC(C)C 62a_100010147026_100000210206 [0,1,1,0,0,0|2,0,0]=4 2338 B14R1.438 Cc1ccc(c(c1)NCF)OC(C)C 34a_200103155816_100015361967 [0,1,1,0,0,0|2,0,0]=4 2339 B14R1.438 Cc1ccc(c(c1)NCF)OC(C)C 7a_200103155816_100015361967 [0,1,1,0,0,0|2,0,0]=4 2340 B14R1.1592 CC(=C(C)c1ccc(cc1CO)C)C 271570a_200000049429_100012361352 [0,1,1,0,0,0|1,0,1]=4 2341 B14R1.1592 CC(C)C(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210206 [0,1,1,0,0,0|2,0,0]=4 2342 B14R1.1592 CC(C)C(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210206 [0,1,1,0,0,0|2,0,0]=4 2343 B14R1.1601 C#Cc1cc(ccc1NC(C)(C)C)C 34a_200012001881_100000210625 [0,1,1,0,0,0|1,0,1]=4 2344 B14R1.1601 CC(C)(C)Nc1ccc(cc1CO)Br 34a_100012353972_100000210625 [0,1,1,0,0,0|1,0,0]=3 2345 B14R1.1601 CC(C)(C)Nc1ccc(cc1CO)Cl 34a_100011214999_100000210625 [0,1,1,0,0,0|1,0,0]=3 2346 B14R1.1601 CC(C)(C)Nc1ccc(cc1CO)F 34a_100011296978_100000210625 [0,1,1,0,0,0|1,0,0]=3 2347 B14R1.1601 CC(C)(C)Oc1ccc(cc1CO)Br 34a_100000184703_100000210625 [0,1,1,0,0,0|2,0,0]=4 2348 B14R1.1601 CC(C)(C)Oc1ccc(cc1CO)Cl 34a_100011218961_100000210625 [0,1,1,0,0,0|2,0,0]=4 2349 B14R1.1601 CC(C)(C)Oc1ccc(cc1CO)F 34a_100011291448_100000210625 [0,1,1,0,0,0|2,0,0]=4 2350 B14R1.1601 CC(C)(C)Oc1ccc(cc1CO)I 34a_100000049520_100000210625 [0,1,1,0,0,0|2,0,0]=4 2351 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)Br 62a_100000211941_100011356890 [0,1,1,0,0,0|2,0,0]=4 2352 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)Br 62a_100011356890_100000211941 [0,1,1,0,0,0|2,0,0]=4 2353 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)F 62a_100000211941_100011217561 [0,1,1,0,0,0|2,0,0]=4 2354 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)F 62a_100011217561_100000211941 [0,1,1,0,0,0|2,0,0]=4 2355 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)N 62a_100000211941_100012347228 [0,1,1,0,0,0|2,0,0]=4 2356 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)N 62a_100012347228_100000211941 [0,1,1,0,0,0|2,0,0]=4 2357 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)O 62a_100000211941_100012351483 [0,1,1,0,0,0|2,0,0]=4 2358 B14R1.1601 CC(C)(C)Sc1ccc(cc1CO)O 62a_100012351483_100000211941 [0,1,1,0,0,0|2,0,0]=4 2359 B14R1.1601 CCc1cc(ccc1NC(C)(C)C)Br 34a_100000686106_100000210625 [0,1,1,0,0,0|2,0,0]=4 2360 B14R1.1601 CCc1cc(ccc1NC(C)(C)C)Cl 34a_100012017146_100000210625 [0,1,1,0,0,0|2,0,0]=4 2361 B14R1.1601 CCc1cc(ccc1NC(C)(C)C)I 34a_100000014069_100000210625 [0,1,1,0,0,0|2,0,0]=4 2362 B14R1.1601 CCc1cc(ccc1OC(C)(C)C)C 34a_100009844793_100000210625 [0,1,1,0,0,0|2,0,0]=4 2363 B14R1.1601 COc1cc(ccc1NC(C)(C)C)C 34a_100000746441_100000210625 [0,1,1,0,0,0|2,0,0]=4 2364 B14R1.1601 Cc1cc(c(cn1)SC(C)(C)C)CO 62a_100000211941_100015579599 [0,1,1,0,0,0|2,0,0]=4 2365 B14R1.1601 Cc1cc(c(cn1)SC(C)(C)C)CO 62a_100015579599_100000211941 [0,1,1,0,0,0|2,0,0]=4 2366 B14R1.1601 Cc1ccc(c(c1)CO)NC(C)(C)C 34a_100011215565_100000210625 [0,1,1,0,0,0|0,0,0]=2 2367 B14R1.1601 Cc1ccc(c(c1)CO)NC(F)(F)F 34a_100011215565_200103152311 [0,1,1,0,0,0|2,0,0]=4 2368 B14R1.1601 Cc1ccc(c(c1)CO)NS(=O)(=O)C 40a_100011215565_100000738038 [0,1,1,0,0,0|2,0,0]=4 2369 B14R1.1601 Cc1ccc(c(c1)CO)OC(C)(C)C 34a_200011846009_100000210625 [0,1,1,0,0,0|1,0,0]=3 2370 B14R1.1601 Cc1ccc(c(c1)CO)SC(C)(C)C 62a_100000211941_100012361352 [0,1,1,0,0,0|1,0,0]=3 2371 B14R1.1601 Cc1ccc(c(c1)CO)SC(C)(C)C 62a_100012361352_100000211941 [0,1,1,0,0,0|1,0,0]=3 2372 B14R1.1601 Cc1ccc(c(n1)CO)OC(C)(C)C 34a_100000751967_100000210625 [0,1,1,0,0,0|2,0,0]=4 2373 B14R1.1601 Cc1ccc(c(n1)CO)SC(C)(C)C 62a_100000211941_100010074375 [0,1,1,0,0,0|2,0,0]=4 2374 B14R1.1601 Cc1ccc(c(n1)CO)SC(C)(C)C 62a_100010074375_100000211941 [0,1,1,0,0,0|2,0,0]=4 2375 B14R1.1601 Cc1cnc(c(c1)CO)SC(C)(C)C 62a_100000118064_100000211941 [0,1,1,0,0,0|2,0,0]=4 2376 B14R1.1601 Cc1cnc(c(c1)CO)SC(C)(C)C 62a_100000211941_100000118064 [0,1,1,0,0,0|2,0,0]=4 2377 B14R1.2295 CC(=Cc1cc(c(cc1CO)C)C)C 271570a_100102525489_100010184405 [0,1,1,0,0,0|1,0,1]=4 2378 B14R1.2295 CC(C)Sc1cc(c(cc1CO)F)F 62a_100000210206_100012344399 [0,1,1,0,0,0|2,0,0]=4 2379 B14R1.2295 CC(C)Sc1cc(c(cc1CO)F)F 62a_100012344399_100000210206 [0,1,1,0,0,0|2,0,0]=4 2380 B14R1.2295 CCc1cc(c(cc1NC(C)C)F)F 2230a_200013084838_100000210206 [0,1,1,0,0,0|2,0,0]=4 2381 B14R1.2295 CCc1cc(c(cc1NC(C)C)F)F 34a_200013084838_100000210206 [0,1,1,0,0,0|2,0,0]=4 2382 B14R1.2295 CCc1cc(c(cc1NC(C)C)F)F 7a_200013084838_100000210206 [0,1,1,0,0,0|2,0,0]=4 2383 B14R1.2295 COc1cc(c(cc1NC(C)C)Cl)C 2230a_100009868623_100000210206 [0,1,1,0,0,0|2,0,0]=4 2384 B14R1.2295 COc1cc(c(cc1NC(C)C)Cl)C 34a_100009868623_100000210206 [0,1,1,0,0,0|2,0,0]=4 2385 B14R1.2295 Cc1cc(c(cc1C)SC(C)C)CO 62a_100000210206_100010184405 [0,1,1,0,0,0|1,0,0]=3 2386 B14R1.2295 Cc1cc(c(cc1C)SC(C)C)CO 62a_100010184405_100000210206 [0,1,1,0,0,0|1,0,0]=3 2387 B14R1.2295 Cc1cc(c(cc1F)NC(C)C)C#N 2230a_100012184636_100000210206 [0,1,1,0,0,0|1,0,1]=4 2388 B14R1.2295 Cc1cc(c(cc1F)NC(C)C)C#N 27a_100138425928_100009816884 [0,1,1,0,0,0|1,0,1]=4 2389 B14R1.2295 Cc1cc(c(cc1F)NC(C)C)C#N 34a_100012184636_100000210206 [0,1,1,0,0,0|1,0,1]=4 2390 B14R1.2295 Cc1cc(c(cc1F)NC(C)C)C#N 7a_100012184636_100000210206 [0,1,1,0,0,0|1,0,1]=4 2391 B14R1.3417 C#CC(C)Nc1ccc(cc1CO)Br 34a_100012353972_200000035995 [0,1,1,0,0,0|1,0,1]=4 2392 B14R1.3417 C#CC(C)Nc1ccc(cc1CO)C 34a_100011215565_200000035995 [0,1,1,0,0,0|0,0,1]=3 2393 B14R1.3417 C#CC(C)Nc1ccc(cc1CO)Cl 34a_100011214999_200000035995 [0,1,1,0,0,0|1,0,1]=4 2394 B14R1.3417 C#CC(C)Nc1ccc(cc1CO)F 34a_100011296978_200000035995 [0,1,1,0,0,0|1,0,1]=4 2395 B14R1.3417 C#CC(C)Oc1ccc(cc1CO)C 34a_200011846009_200000035995 [0,1,1,0,0,0|1,0,1]=4 2396 B14R1.3417 C#CC(C)Sc1ccc(cc1CO)C 62a_200000035995_100012361352 [0,1,1,0,0,0|1,0,1]=4 2397 B14R1.3417 C#Cc1cc(ccc1NC(C)CC)C 34a_200012001881_100011215416 [0,1,1,0,0,0|1,0,1]=4 2398 B14R1.3417 C#Cc1cc(ccc1NC(C)CO)C 34a_200012001881_100012180447 [0,1,1,0,0,0|1,0,1]=4 2399 B14R1.3417 C=CC(C)Sc1ccc(cc1CO)C 62a_100011215867_100012361352 [0,1,1,0,0,0|1,0,1]=4 2400 B14R1.3417 CC(CO)Nc1ccc(cc1CO)Br 34a_100012353972_100012180447 [0,1,1,0,0,0|1,0,0]=3 2401 B14R1.3417 CC(CO)Nc1ccc(cc1CO)Cl 34a_100011214999_100012180447 [0,1,1,0,0,0|1,0,0]=3 2402 B14R1.3417 CC(CO)Nc1ccc(cc1CO)F 34a_100011296978_100012180447 [0,1,1,0,0,0|1,0,0]=3 2403 B14R1.3417 CC(CO)Oc1ccc(cc1CO)Br 34a_100000184703_100012180447 [0,1,1,0,0,0|2,0,0]=4 2404 B14R1.3417 CC(CO)Oc1ccc(cc1CO)Br 7a_100000184703_100012180447 [0,1,1,0,0,0|2,0,0]=4 2405 B14R1.3417 CC(CO)Oc1ccc(cc1CO)Cl 34a_100011218961_100012180447 [0,1,1,0,0,0|2,0,0]=4 2406 B14R1.3417 CC(CO)Oc1ccc(cc1CO)Cl 7a_100011218961_100012180447 [0,1,1,0,0,0|2,0,0]=4 2407 B14R1.3417 CC(CO)Oc1ccc(cc1CO)F 34a_100011291448_100012180447 [0,1,1,0,0,0|2,0,0]=4 2408 B14R1.3417 CC(CO)Oc1ccc(cc1CO)F 7a_100011291448_100012180447 [0,1,1,0,0,0|2,0,0]=4 2409 B14R1.3417 CC(CO)Oc1ccc(cc1CO)I 34a_100000049520_100012180447 [0,1,1,0,0,0|2,0,0]=4 2410 B14R1.3417 CC(CO)Oc1ccc(cc1CO)I 7a_100000049520_100012180447 [0,1,1,0,0,0|2,0,0]=4 2411 B14R1.3417 CC(CO)Sc1ccc(cc1CO)Br 62a_100012180447_100011356890 [0,1,1,0,0,0|2,0,0]=4 2412 B14R1.3417 CC(CO)Sc1ccc(cc1CO)F 62a_100012180447_100011217561 [0,1,1,0,0,0|2,0,0]=4 2413 B14R1.3417 CC(CO)Sc1ccc(cc1CO)N 62a_100012180447_100012347228 [0,1,1,0,0,0|2,0,0]=4 2414 B14R1.3417 CC(CO)Sc1ccc(cc1CO)O 62a_100012180447_100012351483 [0,1,1,0,0,0|2,0,0]=4 2415 B14R1.3417 CCC(=O)Nc1ccc(cc1CO)C 22a_100011215565_100000210414 [0,1,1,0,0,0|1,0,1]=4 2416 B14R1.3417 CCC(=O)Nc1ccc(cc1CO)C 527a_100011215565_100000210414 [0,1,1,0,0,0|1,0,1]=4 2417 B14R1.3417 CCC(C)Nc1ccc(cc1C#N)C 7a_100011934023_100000758301 [0,1,1,0,0,0|1,0,1]=4 2418 B14R1.3417 CCC(C)Nc1ccc(cc1CO)Br 34a_100012353972_100011215416 [0,1,1,0,0,0|1,0,0]=3 2419 B14R1.3417 CCC(C)Nc1ccc(cc1CO)C 34a_100011215565_100011215416 [0,1,1,0,0,0|0,0,0]=2 2420 B14R1.3417 CCC(C)Nc1ccc(cc1CO)Cl 34a_100011214999_100011215416 [0,1,1,0,0,0|1,0,0]=3 2421 B14R1.3417 CCC(C)Nc1ccc(cc1CO)F 34a_100011296978_100011215416 [0,1,1,0,0,0|1,0,0]=3 2422 B14R1.3417 CCC(C)Nc1ccc(cc1OC)C 2230a_100000746441_100000758301 [0,1,1,0,0,0|2,0,0]=4 2423 B14R1.3417 CCC(C)Nc1ccc(cc1OC)C 34a_100000746441_100011215416 [0,1,1,0,0,0|2,0,0]=4 2424 B14R1.3417 CCC(C)Oc1ccc(cc1CO)Br 34a_100000184703_100011215416 [0,1,1,0,0,0|2,0,0]=4 2425 B14R1.3417 CCC(C)Oc1ccc(cc1CO)Br 7a_100000184703_100000758301 [0,1,1,0,0,0|2,0,0]=4 2426 B14R1.3417 CCC(C)Oc1ccc(cc1CO)C 34a_200011846009_100011215416 [0,1,1,0,0,0|1,0,0]=3 2427 B14R1.3417 CCC(C)Oc1ccc(cc1CO)C 7a_200011846009_100000758301 [0,1,1,0,0,0|1,0,0]=3 2428 B14R1.3417 CCC(C)Oc1ccc(cc1CO)Cl 34a_100011218961_100011215416 [0,1,1,0,0,0|2,0,0]=4 2429 B14R1.3417 CCC(C)Oc1ccc(cc1CO)Cl 7a_100011218961_100000758301 [0,1,1,0,0,0|2,0,0]=4 2430 B14R1.3417 CCC(C)Oc1ccc(cc1CO)F 34a_100011291448_100011215416 [0,1,1,0,0,0|2,0,0]=4 2431 B14R1.3417 CCC(C)Oc1ccc(cc1CO)F 7a_100011291448_100000758301 [0,1,1,0,0,0|2,0,0]=4 2432 B14R1.3417 CCC(C)Oc1ccc(cc1CO)I 34a_100000049520_100011215416 [0,1,1,0,0,0|2,0,0]=4 2433 B14R1.3417 CCC(C)Oc1ccc(cc1CO)I 7a_100000049520_100000758301 [0,1,1,0,0,0|2,0,0]=4 2434 B14R1.3417 CCC(C)Oc1ccc(nc1CO)C 34a_100000751967_100011215416 [0,1,1,0,0,0|2,0,0]=4 2435 B14R1.3417 CCC(C)Sc1ccc(cc1CO)Br 62a_100000758301_100011356890 [0,1,1,0,0,0|2,0,0]=4 2436 B14R1.3417 CCC(C)Sc1ccc(cc1CO)Br 62a_100011356890_100000758301 [0,1,1,0,0,0|2,0,0]=4 2437 B14R1.3417 CCC(C)Sc1ccc(cc1CO)C 62a_100000758301_100012361352 [0,1,1,0,0,0|1,0,0]=3 2438 B14R1.3417 CCC(C)Sc1ccc(cc1CO)C 62a_100012361352_100000758301 [0,1,1,0,0,0|1,0,0]=3 2439 B14R1.3417 CCC(C)Sc1ccc(cc1CO)F 62a_100000758301_100011217561 [0,1,1,0,0,0|2,0,0]=4 2440 B14R1.3417 CCC(C)Sc1ccc(cc1CO)F 62a_100011217561_100000758301 [0,1,1,0,0,0|2,0,0]=4 2441 B14R1.3417 CCC(C)Sc1ccc(cc1CO)N 62a_100000758301_100012347228 [0,1,1,0,0,0|2,0,0]=4 2442 B14R1.3417 CCC(C)Sc1ccc(cc1CO)N 62a_100012347228_100000758301 [0,1,1,0,0,0|2,0,0]=4 2443 B14R1.3417 CCC(C)Sc1ccc(cc1CO)O 62a_100000758301_100012351483 [0,1,1,0,0,0|2,0,0]=4 2444 B14R1.3417 CCC(C)Sc1ccc(cc1CO)O 62a_100012351483_100000758301 [0,1,1,0,0,0|2,0,0]=4 2445 B14R1.3417 CCC(C)Sc1ccc(nc1CO)C 62a_100000758301_100010074375 [0,1,1,0,0,0|2,0,0]=4 2446 B14R1.3417 CCC(C)Sc1ccc(nc1CO)C 62a_100010074375_100000758301 [0,1,1,0,0,0|2,0,0]=4 2447 B14R1.3417 CCC(C)Sc1cnc(cc1CO)C 62a_100000758301_100015579599 [0,1,1,0,0,0|2,0,0]=4 2448 B14R1.3417 CCC(C)Sc1cnc(cc1CO)C 62a_100015579599_100000758301 [0,1,1,0,0,0|2,0,0]=4 2449 B14R1.3417 CCC(C)Sc1ncc(cc1CO)C 62a_100000118064_100000758301 [0,1,1,0,0,0|2,0,0]=4 2450 B14R1.3417 CCC(C)Sc1ncc(cc1CO)C 62a_100000758301_100000118064 [0,1,1,0,0,0|2,0,0]=4 2451 B14R1.3417 CCc1cc(ccc1NC(C)CC)Br 2230a_100000686106_100000758301 [0,1,1,0,0,0|2,0,0]=4 2452 B14R1.3417 CCc1cc(ccc1NC(C)CC)Br 34a_100000686106_100011215416 [0,1,1,0,0,0|2,0,0]=4 2453 B14R1.3417 CCc1cc(ccc1NC(C)CC)Br 7a_100000686106_100000758301 [0,1,1,0,0,0|2,0,0]=4 2454 B14R1.3417 CCc1cc(ccc1NC(C)CC)Cl 2230a_100012017146_100000758301 [0,1,1,0,0,0|2,0,0]=4 2455 B14R1.3417 CCc1cc(ccc1NC(C)CC)Cl 34a_100012017146_100011215416 [0,1,1,0,0,0|2,0,0]=4 2456 B14R1.3417 CCc1cc(ccc1NC(C)CC)Cl 7a_100012017146_100000758301 [0,1,1,0,0,0|2,0,0]=4 2457 B14R1.3417 CCc1cc(ccc1NC(C)CC)I 2230a_100000014069_100000758301 [0,1,1,0,0,0|2,0,0]=4 2458 B14R1.3417 CCc1cc(ccc1NC(C)CC)I 34a_100000014069_100011215416 [0,1,1,0,0,0|2,0,0]=4 2459 B14R1.3417 CCc1cc(ccc1NC(C)CC)I 7a_100000014069_100000758301 [0,1,1,0,0,0|2,0,0]=4 2460 B14R1.3417 CCc1cc(ccc1NC(C)CO)Br 2230a_100000686106_100012180447 [0,1,1,0,0,0|2,0,0]=4 2461 B14R1.3417 CCc1cc(ccc1NC(C)CO)Br 34a_100000686106_100012180447 [0,1,1,0,0,0|2,0,0]=4 2462 B14R1.3417 CCc1cc(ccc1NC(C)CO)Br 7a_100000686106_100012180447 [0,1,1,0,0,0|2,0,0]=4 2463 B14R1.3417 CCc1cc(ccc1NC(C)CO)Cl 2230a_100012017146_100012180447 [0,1,1,0,0,0|2,0,0]=4 2464 B14R1.3417 CCc1cc(ccc1NC(C)CO)Cl 34a_100012017146_100012180447 [0,1,1,0,0,0|2,0,0]=4 2465 B14R1.3417 CCc1cc(ccc1NC(C)CO)Cl 7a_100012017146_100012180447 [0,1,1,0,0,0|2,0,0]=4 2466 B14R1.3417 CCc1cc(ccc1NC(C)CO)I 2230a_100000014069_100012180447 [0,1,1,0,0,0|2,0,0]=4 2467 B14R1.3417 CCc1cc(ccc1NC(C)CO)I 34a_100000014069_100012180447 [0,1,1,0,0,0|2,0,0]=4 2468 B14R1.3417 CCc1cc(ccc1NC(C)CO)I 7a_100000014069_100012180447 [0,1,1,0,0,0|2,0,0]=4 2469 B14R1.3417 CCc1cc(ccc1OC(C)CC)C 34a_100009844793_100011215416 [0,1,1,0,0,0|2,0,0]=4 2470 B14R1.3417 CCc1cc(ccc1OC(C)CC)C 7a_100009844793_100000758301 [0,1,1,0,0,0|2,0,0]=4 2471 B14R1.3417 CCc1cc(ccc1OC(C)CO)C 34a_100009844793_100012180447 [0,1,1,0,0,0|2,0,0]=4 2472 B14R1.3417 CCc1cc(ccc1OC(C)CO)C 7a_100009844793_100012180447 [0,1,1,0,0,0|2,0,0]=4 2473 B14R1.3417 COC(C)Sc1ccc(cc1CO)Br 62a_100009879195_100011356890 [0,1,1,0,0,0|2,0,0]=4 2474 B14R1.3417 COC(C)Sc1ccc(cc1CO)Br 62a_100011356890_100009879195 [0,1,1,0,0,0|2,0,0]=4 2475 B14R1.3417 COC(C)Sc1ccc(cc1CO)C 62a_100009879195_100012361352 [0,1,1,0,0,0|1,0,0]=3 2476 B14R1.3417 COC(C)Sc1ccc(cc1CO)C 62a_100012361352_100009879195 [0,1,1,0,0,0|1,0,0]=3 2477 B14R1.3417 COC(C)Sc1ccc(cc1CO)F 62a_100009879195_100011217561 [0,1,1,0,0,0|2,0,0]=4 2478 B14R1.3417 COC(C)Sc1ccc(cc1CO)F 62a_100011217561_100009879195 [0,1,1,0,0,0|2,0,0]=4 2479 B14R1.3417 COC(C)Sc1ccc(cc1CO)N 62a_100009879195_100012347228 [0,1,1,0,0,0|2,0,0]=4 2480 B14R1.3417 COC(C)Sc1ccc(cc1CO)N 62a_100012347228_100009879195 [0,1,1,0,0,0|2,0,0]=4 2481 B14R1.3417 COC(C)Sc1ccc(cc1CO)O 62a_100009879195_100012351483 [0,1,1,0,0,0|2,0,0]=4 2482 B14R1.3417 COC(C)Sc1ccc(cc1CO)O 62a_100012351483_100009879195 [0,1,1,0,0,0|2,0,0]=4 2483 B14R1.3417 COC(C)Sc1ccc(nc1CO)C 62a_100009879195_100010074375 [0,1,1,0,0,0|2,0,0]=4 2484 B14R1.3417 COC(C)Sc1ccc(nc1CO)C 62a_100010074375_100009879195 [0,1,1,0,0,0|2,0,0]=4 2485 B14R1.3417 COC(C)Sc1cnc(cc1CO)C 62a_100009879195_100015579599 [0,1,1,0,0,0|2,0,0]=4 2486 B14R1.3417 COC(C)Sc1cnc(cc1CO)C 62a_100015579599_100009879195 [0,1,1,0,0,0|2,0,0]=4 2487 B14R1.3417 COC(C)Sc1ncc(cc1CO)C 62a_100000118064_100009879195 [0,1,1,0,0,0|2,0,0]=4 2488 B14R1.3417 COC(C)Sc1ncc(cc1CO)C 62a_100009879195_100000118064 [0,1,1,0,0,0|2,0,0]=4 2489 B14R1.3417 COc1cc(ccc1NC(C)CO)C 2230a_100000746441_100012180447 [0,1,1,0,0,0|2,0,0]=4 2490 B14R1.3417 COc1cc(ccc1NC(C)CO)C 34a_100000746441_100012180447 [0,1,1,0,0,0|2,0,0]=4 2491 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)Br 62a_100011356890_100016084084 [0,1,1,0,0,0|2,0,0]=4 2492 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)Br 62a_100016084084_100011356890 [0,1,1,0,0,0|2,0,0]=4 2493 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)F 62a_100011217561_100016084084 [0,1,1,0,0,0|2,0,0]=4 2494 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)F 62a_100016084084_100011217561 [0,1,1,0,0,0|2,0,0]=4 2495 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)N 62a_100012347228_100016084084 [0,1,1,0,0,0|2,0,0]=4 2496 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)N 62a_100016084084_100012347228 [0,1,1,0,0,0|2,0,0]=4 2497 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)O 62a_100012351483_100016084084 [0,1,1,0,0,0|2,0,0]=4 2498 B14R1.3417 C[C@H](CO)Sc1ccc(cc1CO)O 62a_100016084084_100012351483 [0,1,1,0,0,0|2,0,0]=4 2499 B14R1.3417 Cc1cc(c(cn1)SC(C)CO)CO 62a_100012180447_100015579599 [0,1,1,0,0,0|2,0,0]=4 2500 B14R1.3417 Cc1cc(c(cn1)S[C@H](C)CO)CO 62a_100015579599_100016084084 [0,1,1,0,0,0|2,0,0]=4 2501 B14R1.3417 Cc1cc(c(cn1)S[C@H](C)CO)CO 62a_100016084084_100015579599 [0,1,1,0,0,0|2,0,0]=4 2502 B14R1.3417 Cc1ccc(c(c1)C#N)NC(C)CO 7a_100011934023_100012180447 [0,1,1,0,0,0|1,0,1]=4 2503 B14R1.3417 Cc1ccc(c(c1)CO)NC(=O)CO 22a_100011215565_100000210174 [0,1,1,0,0,0|1,0,1]=4 2504 B14R1.3417 Cc1ccc(c(c1)CO)NC(=O)CO 527a_100011215565_100000210174 [0,1,1,0,0,0|1,0,1]=4 2505 B14R1.3417 Cc1ccc(c(c1)CO)NC(C)CO 34a_100011215565_100012180447 [0,1,1,0,0,0|0,0,0]=2 2506 B14R1.3417 Cc1ccc(c(c1)CO)OC(C)C#N 7a_200011846009_100000703298 [0,1,1,0,0,0|1,0,1]=4 2507 B14R1.3417 Cc1ccc(c(c1)CO)OC(C)CO 34a_200011846009_100012180447 [0,1,1,0,0,0|1,0,0]=3 2508 B14R1.3417 Cc1ccc(c(c1)CO)OC(C)CO 7a_200011846009_100012180447 [0,1,1,0,0,0|1,0,0]=3 2509 B14R1.3417 Cc1ccc(c(c1)CO)SC(C)C#N 62a_100000703298_100012361352 [0,1,1,0,0,0|1,0,1]=4 2510 B14R1.3417 Cc1ccc(c(c1)CO)SC(C)C#N 62a_100012361352_100000703298 [0,1,1,0,0,0|1,0,1]=4 2511 B14R1.3417 Cc1ccc(c(c1)CO)SC(C)CO 62a_100012180447_100012361352 [0,1,1,0,0,0|1,0,0]=3 2512 B14R1.3417 Cc1ccc(c(c1)CO)S[C@H](C)CO 62a_100012361352_100016084084 [0,1,1,0,0,0|1,0,0]=3 2513 B14R1.3417 Cc1ccc(c(c1)CO)S[C@H](C)CO 62a_100016084084_100012361352 [0,1,1,0,0,0|1,0,0]=3 2514 B14R1.3417 Cc1ccc(c(n1)CO)OC(C)CO 34a_100000751967_100012180447 [0,1,1,0,0,0|2,0,0]=4 2515 B14R1.3417 Cc1ccc(c(n1)CO)SC(C)CO 62a_100012180447_100010074375 [0,1,1,0,0,0|2,0,0]=4 2516 B14R1.3417 Cc1ccc(c(n1)CO)S[C@H](C)CO 62a_100010074375_100016084084 [0,1,1,0,0,0|2,0,0]=4 2517 B14R1.3417 Cc1ccc(c(n1)CO)S[C@H](C)CO 62a_100016084084_100010074375 [0,1,1,0,0,0|2,0,0]=4 2518 B14R1.3417 Cc1cnc(c(c1)CO)SC(C)CO 62a_100012180447_100000118064 [0,1,1,0,0,0|2,0,0]=4 2519 B14R1.3417 Cc1cnc(c(c1)CO)S[C@H](C)CO 62a_100000118064_100016084084 [0,1,1,0,0,0|2,0,0]=4 2520 B14R1.3417 Cc1cnc(c(c1)CO)S[C@H](C)CO 62a_100016084084_100000118064 [0,1,1,0,0,0|2,0,0]=4 2521 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)Br 2230a_100000694223_100000210206 [0,1,1,0,0,0|2,0,0]=4 2522 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)Br 34a_100000694223_100000210206 [0,1,1,0,0,0|2,0,0]=4 2523 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)Br 7a_100000694223_100000210206 [0,1,1,0,0,0|2,0,0]=4 2524 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)F 2230a_100011941472_100000210206 [0,1,1,0,0,0|2,0,0]=4 2525 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)F 34a_100011941472_100000210206 [0,1,1,0,0,0|2,0,0]=4 2526 B14R1.6074 CC(C)Nc1ccc(cc1C(C)C)F 7a_100011941472_100000210206 [0,1,1,0,0,0|2,0,0]=4 2527 B14R1.6074 CC(C)Oc1ccc(cc1C(C)O)F 34a_200011305312_100000210206 [0,1,1,0,0,0|2,0,0]=4 2528 B14R1.6074 CC(C)Oc1ccc(cc1C(C)O)F 7a_200011305312_100000210206 [0,1,1,0,0,0|2,0,0]=4 2529 B14R1.6074 CC(C)Sc1ccc(cc1[C@H](C)O)F 62a_100000210206_100134768474 [0,1,1,0,0,0|2,0,0]=4 2530 B14R1.6074 CC(C)Sc1ccc(cc1[C@H](C)O)F 62a_100134768474_100000210206 [0,1,1,0,0,0|2,0,0]=4 2531 B14R1.6074 Cc1ccc(c(c1)B(O)O)SC(C)C 62a_100000210206_200010883979 [0,1,1,0,0,0|2,0,0]=4 2532 B14R1.6074 Cc1ccc(c(c1)B(O)O)SC(C)C 62a_200010883979_100000210206 [0,1,1,0,0,0|2,0,0]=4 2533 B14R1.6074 Cc1ccc(c(c1)C(=O)N)NC(C)C 34a_100011692829_100000210206 [0,1,1,0,0,0|0,0,2]=4 2534 B14R1.12031 CC(C)Sc1ccc(c(c1CO)F)F 62a_100000210206_100010177773 [0,1,1,0,0,0|2,0,0]=4 2535 B14R1.12031 CC(C)Sc1ccc(c(c1CO)F)F 62a_100010177773_100000210206 [0,1,1,0,0,0|2,0,0]=4 2536 B14R1.12031 Cc1ccc(c(c1F)C#N)NC(C)C 27a_100138425928_100000062008 [0,1,1,0,0,0|1,0,1]=4 2537 B14R1.67 CC(C)c1cc(ccc1NCCF)Br 2230a_100000694223_100011217306 [0,1,1,0,0,0|2,0,0]=4 2538 B14R1.67 CC(C)c1cc(ccc1NCCF)Br 34a_100000694223_100011217306 [0,1,1,0,0,0|2,0,0]=4 2539 B14R1.67 CC(C)c1cc(ccc1NCCF)Br 7a_100000694223_100011217306 [0,1,1,0,0,0|2,0,0]=4 2540 B14R1.67 CC(C)c1cc(ccc1NCCF)F 2230a_100011941472_100011217306 [0,1,1,0,0,0|2,0,0]=4 2541 B14R1.67 CC(C)c1cc(ccc1NCCF)F 34a_100011941472_100011217306 [0,1,1,0,0,0|2,0,0]=4 2542 B14R1.67 CC(C)c1cc(ccc1NCCF)F 7a_100011941472_100011217306 [0,1,1,0,0,0|2,0,0]=4 2543 B14R1.67 CC(C)c1cc(ccc1NCCO)Br 2230a_100000694223_100000211926 [0,1,1,0,0,0|2,0,0]=4 2544 B14R1.67 CC(C)c1cc(ccc1NCCO)Br 34a_100000694223_100000211926 [0,1,1,0,0,0|2,0,0]=4 2545 B14R1.67 CC(C)c1cc(ccc1NCCO)Br 7a_100000694223_100000211926 [0,1,1,0,0,0|2,0,0]=4 2546 B14R1.67 CC(C)c1cc(ccc1NCCO)F 2230a_100011941472_100000211926 [0,1,1,0,0,0|2,0,0]=4 2547 B14R1.67 CC(C)c1cc(ccc1NCCO)F 34a_100011941472_100000211926 [0,1,1,0,0,0|2,0,0]=4 2548 B14R1.67 CC(C)c1cc(ccc1NCCO)F 7a_100011941472_100000211926 [0,1,1,0,0,0|2,0,0]=4 2549 B14R1.67 CC(O)c1cc(ccc1OCCF)F 34a_200011305312_100011217306 [0,1,1,0,0,0|2,0,0]=4 2550 B14R1.67 CC(O)c1cc(ccc1OCCF)F 7a_200011305312_100011217306 [0,1,1,0,0,0|2,0,0]=4 2551 B14R1.67 CC(O)c1cc(ccc1OCCO)F 34a_200011305312_100000211926 [0,1,1,0,0,0|2,0,0]=4 2552 B14R1.67 CC(O)c1cc(ccc1OCCO)F 7a_200011305312_100000211926 [0,1,1,0,0,0|2,0,0]=4 2553 B14R1.67 CCCCc1ccc(cc1[C@H](C)O)F 271570a_100020621405_100134768474 [0,1,1,0,0,0|2,0,0]=4 2554 B14R1.67 CCCNc1ccc(cc1C(C)C)Br 2230a_100000694223_100000210303 [0,1,1,0,0,0|2,0,0]=4 2555 B14R1.67 CCCNc1ccc(cc1C(C)C)Br 34a_100000694223_100000210303 [0,1,1,0,0,0|2,0,0]=4 2556 B14R1.67 CCCNc1ccc(cc1C(C)C)Br 7a_100000694223_100000210303 [0,1,1,0,0,0|2,0,0]=4 2557 B14R1.67 CCCNc1ccc(cc1C(C)C)F 2230a_100011941472_100000210303 [0,1,1,0,0,0|2,0,0]=4 2558 B14R1.67 CCCNc1ccc(cc1C(C)C)F 34a_100011941472_100000210303 [0,1,1,0,0,0|2,0,0]=4 2559 B14R1.67 CCCNc1ccc(cc1C(C)C)F 7a_100011941472_100000210303 [0,1,1,0,0,0|2,0,0]=4 2560 B14R1.67 CCCOc1ccc(cc1C(C)O)F 34a_200011305312_100000210303 [0,1,1,0,0,0|2,0,0]=4 2561 B14R1.67 CCCOc1ccc(cc1C(C)O)F 7a_200011305312_100000210303 [0,1,1,0,0,0|2,0,0]=4 2562 B14R1.67 CCCSc1ccc(cc1[C@H](C)O)F 62a_100000210303_100134768474 [0,1,1,0,0,0|2,0,0]=4 2563 B14R1.67 CCCSc1ccc(cc1[C@H](C)O)F 62a_100134768474_100000210303 [0,1,1,0,0,0|2,0,0]=4 2564 B14R1.67 COCNc1ccc(cc1C(C)C)Br 2230a_100000694223_100000766300 [0,1,1,0,0,0|2,0,0]=4 2565 B14R1.67 COCNc1ccc(cc1C(C)C)F 2230a_100011941472_100000766300 [0,1,1,0,0,0|2,0,0]=4 2566 B14R1.67 COCSc1ccc(cc1[C@H](C)O)F 62a_100000766300_100134768474 [0,1,1,0,0,0|2,0,0]=4 2567 B14R1.67 COCSc1ccc(cc1[C@H](C)O)F 62a_100134768474_100000766300 [0,1,1,0,0,0|2,0,0]=4 2568 B14R1.67 CSCNc1ccc(cc1C(C)C)Br 2230a_100000694223_100011218213 [0,1,1,0,0,0|2,0,0]=4 2569 B14R1.67 CSCNc1ccc(cc1C(C)C)Br 34a_100000694223_100011218213 [0,1,1,0,0,0|2,0,0]=4 2570 B14R1.67 CSCNc1ccc(cc1C(C)C)F 2230a_100011941472_100011218213 [0,1,1,0,0,0|2,0,0]=4 2571 B14R1.67 CSCNc1ccc(cc1C(C)C)F 34a_100011941472_100011218213 [0,1,1,0,0,0|2,0,0]=4 2572 B14R1.67 CSCOc1ccc(cc1C(C)O)F 34a_200011305312_100011218213 [0,1,1,0,0,0|2,0,0]=4 2573 B14R1.67 CSCSc1ccc(cc1[C@H](C)O)F 62a_100011218213_100134768474 [0,1,1,0,0,0|2,0,0]=4 2574 B14R1.67 CSCSc1ccc(cc1[C@H](C)O)F 62a_100134768474_100011218213 [0,1,1,0,0,0|2,0,0]=4 2575 B14R1.67 C[C@H](O)c1cc(ccc1SCCF)F 62a_100011217306_100134768474 [0,1,1,0,0,0|2,0,0]=4 2576 B14R1.67 C[C@H](O)c1cc(ccc1SCCF)F 62a_100134768474_100011217306 [0,1,1,0,0,0|2,0,0]=4 2577 B14R1.67 C[C@H](O)c1cc(ccc1SCCO)F 62a_100000211926_100134768474 [0,1,1,0,0,0|2,0,0]=4 2578 B14R1.67 C[C@H](O)c1cc(ccc1SCCO)F 62a_100134768474_100000211926 [0,1,1,0,0,0|2,0,0]=4 2579 B14R1.1126 CCN(C)c1ccc(cc1C(=O)O)C 269956a_100000216468_200000210301 [0,1,1,0,0,0|1,0,1]=4 2580 B14R1.1126 CCN([13CH3])c1ccc(cc1C(=O)O)C 269956a_100000216468_200025704644 [0,1,1,0,0,0|1,0,1]=4 2581 B14R1.5237 CCNc1ccc(cc1C(C)C)C#N 27a_100015525214_100021510006 [0,1,1,0,0,0|1,0,1]=4 2582 B14R1.5237 CCOc1ccc(cc1C(C)C)OC 34a_100011998526_100000210202 [0,1,1,0,0,0|2,0,0]=4 2583 B14R1.5237 CCOc1ccc(cc1C(C)C)OC 7a_100011998526_100000210202 [0,1,1,0,0,0|2,0,0]=4 2584 B14R1.5237 CCSc1ccc(cc1[C@H](C)N)OC 62a_100000210202_200015425320 [0,1,1,0,0,0|2,0,0]=4 2585 B14R1.5237 CCSc1ccc(cc1[C@H](C)N)OC 62a_200015425320_100000210202 [0,1,1,0,0,0|2,0,0]=4 2586 B14R1.6722 CCNc1ccc(cc1C(C)(C)C)Br 2230a_100010286096_100000210202 [0,1,1,0,0,0|2,0,0]=4 2587 B14R1.6722 CCNc1ccc(cc1C(C)(C)C)Br 34a_100010286096_100000210202 [0,1,1,0,0,0|2,0,0]=4 2588 B14R1.6722 CCNc1ccc(cc1C(C)(C)C)Br 7a_100010286096_100000210202 [0,1,1,0,0,0|2,0,0]=4 2589 B14R1.6722 CCNc1ccc(cc1C(F)(F)F)C 34a_200011214901_100000210202 [0,1,1,0,0,0|2,0,0]=4 2590 B14R1.6722 CCNc1ccc(cc1C(F)(F)F)C 7a_200011214901_100000210202 [0,1,1,0,0,0|2,0,0]=4 2591 B14R1.6722 CCNc1ccc(cc1P(=O)(C)C)C 2230a_202126155009_100000210202 [0,1,1,0,0,0|1,0,1]=4 2592 B14R1.6722 CCNc1ccc(cc1P(=O)(C)C)C 34a_202126155009_100000210202 [0,1,1,0,0,0|1,0,1]=4 2593 B14R1.6722 CCNc1ccc(cc1P(=O)(C)C)C 7a_202126155009_100000210202 [0,1,1,0,0,0|1,0,1]=4 2594 B14R1.6722 CCOc1ccc(cc1C(C)(C)C)C 34a_100000211090_100000210202 [0,1,1,0,0,0|2,0,0]=4 2595 B14R1.6722 CCOc1ccc(cc1C(C)(C)C)C 7a_100000211090_100000210202 [0,1,1,0,0,0|2,0,0]=4 2596 B14R1.14774 CCNc1c(cc(cc1C(C)C)Br)Br 34a_200010244484_100000210202 [0,1,1,0,0,0|2,0,0]=4 2597 B14R1.14774 CCNc1c(cc(cc1C(C)C)Br)Br 7a_200010244484_100000210202 [0,1,1,0,0,0|2,0,0]=4 2598 B14R1.14774 CCNc1c(cc(cc1C(C)C)F)Br 34a_202125602415_100000210202 [0,1,1,0,0,0|2,0,0]=4 2599 B14R1.14774 CCNc1c(cc(cc1C(C)C)F)Br 7a_202125602415_100000210202 [0,1,1,0,0,0|2,0,0]=4 2600 B14R1.74 CC(C)C[C@H](N)c1cccc(c1)CF 271570a_100015190218_100010878472 [0,1,1,0,0,0|2,0,0]=4 2601 B14R1.74 CC(C)C[C@H](N)c1cccc(c1)CN 271570a_100015190218_100000106179 [0,1,1,0,0,0|2,0,0]=4 2602 B14R1.74 CC(C)C[C@H](N)c1cccc(c1)CO 271570a_100015190218_100000687537 [0,1,1,0,0,0|2,0,0]=4 2603 B14R1.74 CCc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000684523 [0,1,1,0,0,0|2,0,0]=4 2604 B14R1.74 CNc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000219648 [0,1,1,0,0,0|2,0,0]=4 2605 B14R1.74 COc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000170001 [0,1,1,0,0,0|2,0,0]=4 2606 B14R1.74 CSc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100011215954 [0,1,1,0,0,0|2,0,0]=4 2607 B14R1.150 Cc1cccc(c1)C(O)C(=O)C(C)C 1458a_100011434945_100000210206 [0,1,1,0,0,0|1,0,1]=4 2608 B14R1.152 Cc1cccc(c1C)[C@@H](N)CC(C)C 271570a_100015190218_100011214922 [0,1,1,0,0,0|2,0,0]=4 2609 B14R1.152 Cc1cccc(c1Cl)[C@@H](N)CC(C)C 271570a_100015190218_200012352035 [0,1,1,0,0,0|2,0,0]=4 2610 B14R1.152 Cc1cccc(c1F)[C@@H](N)CC(C)C 271570a_100015190218_100000717567 [0,1,1,0,0,0|2,0,0]=4 2611 B14R1.152 Cc1cccc(c1N)[C@@H](N)CC(C)C 271570a_100015190218_100011834072 [0,1,1,0,0,0|2,0,0]=4 2612 B14R1.152 Cc1cccc(c1O)[C@@H](N)CC(C)C 271570a_100015190218_100009817157 [0,1,1,0,0,0|2,0,0]=4 2613 B14R1.685 Cc1cc(ccc1Br)[C@@H](N)CC(C)C 271570a_100015190218_100009813585 [0,1,1,0,0,0|2,0,0]=4 2614 B14R1.685 Cc1cc(ccc1Cl)[C@@H](N)CC(C)C 271570a_100015190218_100000049509 [0,1,1,0,0,0|2,0,0]=4 2615 B14R1.685 Cc1cc(ccc1F)[C@@H](N)CC(C)C 271570a_100015190218_100011218330 [0,1,1,0,0,0|2,0,0]=4 2616 B14R1.685 Cc1cc(ccc1N)[C@@H](N)CC(C)C 271570a_100015190218_100000211769 [0,1,1,0,0,0|2,0,0]=4 2617 B14R1.685 Cc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000186361 [0,1,1,0,0,0|2,0,0]=4 2618 B14R1.685 Cc1ccc(cc1C)[C@@H](N)CC(C)C 271570a_100015190218_100011215607 [0,1,1,0,0,0|2,0,0]=4 2619 B14R1.1020 Cc1cccc(c1)[C@@H](CO)NC(C)C 2230a_100009818812_100000210206 [0,1,1,0,0,0|2,0,0]=4 2620 B14R1.1020 Cc1cccc(c1)[C@@H](CO)NC(C)C 34a_100009818812_100000210206 [0,1,1,0,0,0|2,0,0]=4 2621 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)C 271570a_100015190218_100011215608 [0,1,1,0,0,0|2,0,0]=4 2622 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)Cl 271570a_100015190218_100010172791 [0,1,1,0,0,0|2,0,0]=4 2623 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)F 271570a_100015190218_100011356977 [0,1,1,0,0,0|2,0,0]=4 2624 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)N 271570a_100015190218_100000695972 [0,1,1,0,0,0|2,0,0]=4 2625 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)O 271570a_100015190218_100011999630 [0,1,1,0,0,0|2,0,0]=4 2626 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)Br 271570a_100015190218_100012353751 [0,1,1,0,0,0|2,0,0]=4 2627 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)C 271570a_100015190218_100000210833 [0,1,1,0,0,0|2,0,0]=4 2628 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)Cl 271570a_100015190218_100012356289 [0,1,1,0,0,0|2,0,0]=4 2629 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)F 271570a_100015190218_100000736223 [0,1,1,0,0,0|2,0,0]=4 2630 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)N 271570a_100015190218_100000210942 [0,1,1,0,0,0|2,0,0]=4 2631 B14R1.6052 Cc1ccc(c(c1)[C@@H](N)CC(C)C)O 271570a_100015190218_100000765521 [0,1,1,0,0,0|2,0,0]=4 2632 B14R1.185 CCCC(NC)c1cc(ccc1C)C 269862a_106832991636_200011267391 [0,1,1,0,0,0|2,0,0]=4 2633 B14R1.918 CCCNC(C)c1cc(ccc1Br)C 269862a_100020643023_100012361225 [0,1,1,0,0,0|2,0,0]=4 2634 B14R1.918 CCCNC(C)c1cc(ccc1C)C 269862a_100020643023_100000211711 [0,1,1,0,0,0|2,0,0]=4 2635 B14R1.918 CCCNC(C)c1cc(ccc1F)C 269862a_100020643023_100000760338 [0,1,1,0,0,0|2,0,0]=4 2636 B14R1.918 CCCNC(C)c1cc(ccc1O)C 269862a_100020643023_100000195442 [0,1,1,0,0,0|2,0,0]=4 2637 B14R1.918 CCCN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_100000210303 [0,1,1,0,0,0|2,0,0]=4 2638 B14R1.918 CCCN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_100000210303 [0,1,1,0,0,0|2,0,0]=4 2639 B14R1.918 CCCOC(C)c1cc(ccc1C)C 34a_200000246511_100000210303 [0,1,1,0,0,0|2,0,0]=4 2640 B14R1.918 CCCOC(C)c1cc(ccc1C)C 7a_200000246511_100000210303 [0,1,1,0,0,0|2,0,0]=4 2641 B14R1.988 CCC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_100000210202 [0,1,1,0,0,0|1,0,1]=4 2642 B14R2.142 C=Cc1ccc2c(c1)C(CCC2)O 271570a_100011290941_100011660633 [1,1,0,0,0,0|1,0,1]=4 2643 B14R2.142 C=Cc1ccc2c(c1)C(CCN2)C 271570a_100011290941_200013856564 [1,1,0,0,0,0|1,0,1]=4 2644 B14R2.142 C=Cc1ccc2c(c1)C(CCO2)O 271570a_100011290941_100000760992 [1,1,0,0,0,0|1,0,1]=4 2645 B14R2.142 CC1CCNc2c1cc(cc2)S[13CH3] 62a_200013856564_200025704644 [1,1,0,0,0,0|1,0,0]=3 2646 B14R2.142 CC1CCNc2c1cc(cc2)S[13CH3] 62a_200025704644_200013856564 [1,1,0,0,0,0|1,0,0]=3 2647 B14R2.142 CSc1ccc2c(c1)C(=O)CCN2 62a_100000697366_200000210301 [1,1,0,0,0,0|0,0,2]=4 2648 B14R2.142 CSc1ccc2c(c1)C(=O)CCN2 62a_200000210301_100000697366 [1,1,0,0,0,0|0,0,2]=4 2649 B14R2.142 CSc1ccc2c(c1)C(CCC2)N 62a_100011742594_200000210301 [1,1,0,0,0,0|2,0,0]=4 2650 B14R2.142 CSc1ccc2c(c1)C(CCC2)N 62a_200000210301_100011742594 [1,1,0,0,0,0|2,0,0]=4 2651 B14R2.142 CSc1ccc2c(c1)C(CCC2)O 62a_100011660633_200000210301 [1,1,0,0,0,0|1,0,0]=3 2652 B14R2.142 CSc1ccc2c(c1)C(CCC2)O 62a_200000210301_100011660633 [1,1,0,0,0,0|1,0,0]=3 2653 B14R2.142 CSc1ccc2c(c1)C(CCN2)C 62a_200000210301_200013856564 [1,1,0,0,0,0|1,0,0]=3 2654 B14R2.142 CSc1ccc2c(c1)C(CCN2)C 62a_200013856564_200000210301 [1,1,0,0,0,0|1,0,0]=3 2655 B14R2.142 CSc1ccc2c(c1)C(CCO2)O 62a_100000760992_200000210301 [1,1,0,0,0,0|1,0,0]=3 2656 B14R2.142 CSc1ccc2c(c1)C(CCO2)O 62a_200000210301_100000760992 [1,1,0,0,0,0|1,0,0]=3 2657 B14R2.142 CSc1ccc2c(c1)C(CCS2)N 62a_100000744474_200000210301 [1,1,0,0,0,0|2,0,0]=4 2658 B14R2.142 CSc1ccc2c(c1)C(CCS2)N 62a_200000210301_100000744474 [1,1,0,0,0,0|2,0,0]=4 2659 B14R2.142 CSc1ccc2c(c1)[C@H](CCO2)N 62a_100020639276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2660 B14R2.142 CSc1ccc2c(c1)[C@H](CCO2)N 62a_200000210301_100020639276 [1,1,0,0,0,0|2,0,0]=4 2661 B14R2.142 [13CH3]Sc1ccc2c(c1)C(=O)CCN2 62a_100000697366_200025704644 [1,1,0,0,0,0|0,0,2]=4 2662 B14R2.142 [13CH3]Sc1ccc2c(c1)C(=O)CCN2 62a_200025704644_100000697366 [1,1,0,0,0,0|0,0,2]=4 2663 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCC2)N 62a_100011742594_200025704644 [1,1,0,0,0,0|2,0,0]=4 2664 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCC2)N 62a_200025704644_100011742594 [1,1,0,0,0,0|2,0,0]=4 2665 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCC2)O 62a_100011660633_200025704644 [1,1,0,0,0,0|1,0,0]=3 2666 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCC2)O 62a_200025704644_100011660633 [1,1,0,0,0,0|1,0,0]=3 2667 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCO2)O 62a_100000760992_200025704644 [1,1,0,0,0,0|1,0,0]=3 2668 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCO2)O 62a_200025704644_100000760992 [1,1,0,0,0,0|1,0,0]=3 2669 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCS2)N 62a_100000744474_200025704644 [1,1,0,0,0,0|2,0,0]=4 2670 B14R2.142 [13CH3]Sc1ccc2c(c1)C(CCS2)N 62a_200025704644_100000744474 [1,1,0,0,0,0|2,0,0]=4 2671 B14R2.142 [13CH3]Sc1ccc2c(c1)[C@H](CCO2)N 62a_100020639276_200025704644 [1,1,0,0,0,0|2,0,0]=4 2672 B14R2.142 [13CH3]Sc1ccc2c(c1)[C@H](CCO2)N 62a_200025704644_100020639276 [1,1,0,0,0,0|2,0,0]=4 2673 B14R2.4536 CC1(CCNc2c1cc(cc2)O)C 271570a_203496583355_100016987449 [1,1,0,0,0,0|2,0,0]=4 2674 B14R2.11684 CNC1CCCc2c1cc(cc2)C 2230a_100015204190_200000210301 [1,1,0,0,0,0|2,0,0]=4 2675 B14R2.11684 CNC1CCCc2c1cc(cc2)C 269862a_106832991636_100000685544 [1,1,0,0,0,0|2,0,0]=4 2676 B14R2.11684 CNC1CCCc2c1cc(cc2)C 34a_100015204190_200000210301 [1,1,0,0,0,0|2,0,0]=4 2677 B14R2.11684 CNC1CCSc2c1cc(cc2)C 269862a_106832991636_100011247500 [1,1,0,0,0,0|2,0,0]=4 2678 B14R2.11684 COC1CCCc2c1cc(cc2)Br 34a_100011660633_200000210301 [1,1,0,0,0,0|2,0,0]=4 2679 B14R2.11684 COC1CCCc2c1cc(cc2)Br 7a_100011660633_200000210301 [1,1,0,0,0,0|2,0,0]=4 2680 B14R2.11684 COC1CCCc2c1cc(cc2)N 34a_100009883350_200000210301 [1,1,0,0,0,0|2,0,0]=4 2681 B14R2.11684 COC1CCOc2c1cc(cc2)Br 7a_100000760992_200000210301 [1,1,0,0,0,0|2,0,0]=4 2682 B14R2.11684 Cc1ccc2c(c1)C(CCC2)N[13CH3] 2230a_100015204190_200025704644 [1,1,0,0,0,0|2,0,0]=4 2683 B14R2.11684 Cc1ccc2c(c1)C(CCC2)N[13CH3] 34a_100015204190_200025704644 [1,1,0,0,0,0|2,0,0]=4 2684 B14R2.11684 [13CH3]OC1CCCc2c1cc(cc2)Br 34a_100011660633_200025704644 [1,1,0,0,0,0|2,0,0]=4 2685 B14R2.11684 [13CH3]OC1CCCc2c1cc(cc2)Br 7a_100011660633_200025704644 [1,1,0,0,0,0|2,0,0]=4 2686 B14R2.11684 [13CH3]OC1CCCc2c1cc(cc2)N 34a_100009883350_200025704644 [1,1,0,0,0,0|2,0,0]=4 2687 B14R2.11684 [13CH3]OC1CCOc2c1cc(cc2)Br 7a_100000760992_200025704644 [1,1,0,0,0,0|2,0,0]=4 2688 B14R2.2332 C=Cc1ccc2c(c1)CCC(N2)C 271570a_100011290941_100010333662 [1,1,0,0,0,0|0,0,1]=3 2689 B14R2.2332 CC1CCc2cc(ccc2N1)S[13CH3] 62a_100010333662_200025704644 [1,1,0,0,0,0|0,0,0]=2 2690 B14R2.2332 CC1CCc2cc(ccc2N1)S[13CH3] 62a_200025704644_100010333662 [1,1,0,0,0,0|0,0,0]=2 2691 B14R2.2332 CC1Cc2ccc(cc2CN1)S[13CH3] 62a_200000706634_200025704644 [1,1,0,0,0,0|2,0,0]=4 2692 B14R2.2332 CC1Cc2ccc(cc2CN1)S[13CH3] 62a_200025704644_200000706634 [1,1,0,0,0,0|2,0,0]=4 2693 B14R2.2332 CCN1CCc2cc(ccc2C1)C 2230a_100000718575_100000210202 [1,1,0,0,0,0|2,0,0]=4 2694 B14R2.2332 CCN1CCc2cc(ccc2C1)C 269982a_100000718575_100000204670 [1,1,0,0,0,0|2,0,0]=4 2695 B14R2.2332 CCN1CCc2cc(ccc2C1)C 34a_100000718575_100000210202 [1,1,0,0,0,0|2,0,0]=4 2696 B14R2.2332 CN1CCc2cc(ccc2C1)N[13CH3] 34a_100009954699_200025704644 [1,1,0,0,0,0|2,0,0]=4 2697 B14R2.2332 CN1CCc2cc(ccc2C1)O[13CH3] 34a_200009882110_200025704644 [1,1,0,0,0,0|2,0,0]=4 2698 B14R2.2332 CNC1CCc2cc(ccc2C1)Br 270004a_106832991635_100000753102 [1,1,0,0,0,0|2,0,0]=4 2699 B14R2.2332 CNC1CCc2cc(ccc2C1)Cl 270004a_106832991635_100000067585 [1,1,0,0,0,0|2,0,0]=4 2700 B14R2.2332 CNC1CCc2cc(ccc2C1)F 270004a_106832991635_100000067110 [1,1,0,0,0,0|2,0,0]=4 2701 B14R2.2332 CNC1CCc2cc(ccc2C1)O 270004a_106832991635_100009852394 [1,1,0,0,0,0|2,0,0]=4 2702 B14R2.2332 CNc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200000210301 [1,1,0,0,0,0|1,0,1]=4 2703 B14R2.2332 CNc1ccc2c(c1)CCN(C2)C 34a_100009954699_200000210301 [1,1,0,0,0,0|2,0,0]=4 2704 B14R2.2332 COC1CCc2cc(ccc2C1)F 34a_100000081312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2705 B14R2.2332 COC1CCc2cc(ccc2C1)F 7a_100000081312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2706 B14R2.2332 COc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200000210301 [1,1,0,0,0,0|1,0,1]=4 2707 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 2230a_100015189960_200000210301 [1,1,0,0,0,0|2,0,0]=4 2708 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 269982a_100015189960_200000210301 [1,1,0,0,0,0|2,0,0]=4 2709 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_100015189960_200000210301 [1,1,0,0,0,0|2,0,0]=4 2710 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_200009882110_200000210301 [1,1,0,0,0,0|2,0,0]=4 2711 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 2230a_100015189960_200025704644 [1,1,0,0,0,0|2,0,0]=4 2712 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 269982a_100015189960_200025704644 [1,1,0,0,0,0|2,0,0]=4 2713 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 34a_100015189960_200025704644 [1,1,0,0,0,0|2,0,0]=4 2714 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200000210301 [1,1,0,0,0,0|1,0,1]=4 2715 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_200000210301_100000754843 [1,1,0,0,0,0|1,0,1]=4 2716 B14R2.2332 CSc1ccc2c(c1)CCC(N2)C 62a_100010333662_200000210301 [1,1,0,0,0,0|0,0,0]=2 2717 B14R2.2332 CSc1ccc2c(c1)CCC(N2)C 62a_200000210301_100010333662 [1,1,0,0,0,0|0,0,0]=2 2718 B14R2.2332 CSc1ccc2c(c1)CNC(C2)C 62a_200000210301_200000706634 [1,1,0,0,0,0|2,0,0]=4 2719 B14R2.2332 CSc1ccc2c(c1)CNC(C2)C 62a_200000706634_200000210301 [1,1,0,0,0,0|2,0,0]=4 2720 B14R2.2332 Cc1ccc2c(c1)CCN(C2)CF 269982a_100000718575_100015361967 [1,1,0,0,0,0|2,0,0]=4 2721 B14R2.2332 Cc1ccc2c(c1)CCN(C2)CF 34a_100000718575_100015361967 [1,1,0,0,0,0|2,0,0]=4 2722 B14R2.2332 [13CH3]Nc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200025704644 [1,1,0,0,0,0|1,0,1]=4 2723 B14R2.2332 [13CH3]OC1CCc2cc(ccc2C1)F 34a_100000081312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2724 B14R2.2332 [13CH3]OC1CCc2cc(ccc2C1)F 7a_100000081312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2725 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200025704644 [1,1,0,0,0,0|1,0,1]=4 2726 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200025704644 [1,1,0,0,0,0|1,0,1]=4 2727 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_200025704644_100000754843 [1,1,0,0,0,0|1,0,1]=4 2728 B14R2.19008 CNC1c2cc(ccc2CC1C)C 269862a_106832991636_100000698133 [0,1,0,0,1,0|2,0,0]=4 2729 B16R2.204026 CC1CC(Nc2c1cc(cc2)O[13CH3])(C)C 34a_100000027390_200025704644 [0,2,0,0,0,0|1,0,0]=3 2730 B16R2.204026 CC1CC(Nc2c1cc(cc2)O[13CH3])(C)C 7a_100000027390_200025704644 [0,2,0,0,0,0|1,0,0]=3 2731 B16R2.204026 COc1ccc2c(c1)C(CC(N2)(C)C)C 34a_100000027390_200000210301 [0,2,0,0,0,0|1,0,0]=3 2732 B16R2.204026 COc1ccc2c(c1)C(CC(N2)(C)C)C 7a_100000027390_200000210301 [0,2,0,0,0,0|1,0,0]=3 2733 B16R2.198982 CNC1CC(Oc2c1cc(cc2)C)(C)C 2230a_100015187214_200000210301 [0,2,0,0,0,0|2,0,0]=4 2734 B16R2.198982 CNC1CC(Oc2c1cc(cc2)C)(C)C 34a_100015187214_200000210301 [0,2,0,0,0,0|2,0,0]=4 2735 B16R2.198982 Cc1ccc2c(c1)C(CC(O2)(C)C)N[13CH3] 2230a_100015187214_200025704644 [0,2,0,0,0,0|2,0,0]=4 2736 B16R2.198982 Cc1ccc2c(c1)C(CC(O2)(C)C)N[13CH3] 34a_100015187214_200025704644 [0,2,0,0,0,0|2,0,0]=4 2737 B14R2.72 Brc1ccc(cc1)NC2CCCC2 2230a_100000210018_100000179811 [0,0,1,1,0,0|2,0,0]=4 2738 B14R2.72 Brc1ccc(cc1)NC2CCCC2 34a_100000210018_100000179811 [0,0,1,1,0,0|2,0,0]=4 2739 B14R2.72 Brc1ccc(cc1)NC2CCOC2 2230a_100000210018_100000731011 [0,0,1,1,0,0|1,0,0]=3 2740 B14R2.72 Brc1ccc(cc1)NC2CCOC2 34a_100000210018_100000690089 [0,0,1,1,0,0|1,0,0]=3 2741 B14R2.72 Brc1ccc(cc1)OC2CCOC2 34a_100000185759_100000690089 [0,0,1,1,0,0|2,0,0]=4 2742 B14R2.72 Brc1ccc(cc1)OC2CCOC2 7a_100000185759_100000731011 [0,0,1,1,0,0|2,0,0]=4 2743 B14R2.72 Brc1ccc(cc1)SC2CCOC2 62a_100000752885_100000690089 [0,0,1,1,0,0|2,0,0]=4 2744 B14R2.72 Brc1ccc(nc1)N[C@@H]2CCOC2 27a_200015188469_100000686858 [0,0,1,1,0,0|2,0,0]=4 2745 B14R2.72 Brc1ccc(nc1)N[C@H]2CCOC2 27a_100015188467_100000686858 [0,0,1,1,0,0|2,0,0]=4 2746 B14R2.72 Cc1ccc(cc1)NC2CCCC2 34a_100000124888_100000179811 [0,0,1,1,0,0|1,0,0]=3 2747 B14R2.72 Cc1ccc(cc1)NC2CCOC2 34a_100000124888_100000690089 [0,0,1,1,0,0|0,0,0]=2 2748 B14R2.72 Cc1ccc(cc1)OC2CCCC2 34a_100000210336_100000179811 [0,0,1,1,0,0|2,0,0]=4 2749 B14R2.72 Cc1ccc(cc1)OC2CCCC2 7a_100000210336_100000179811 [0,0,1,1,0,0|2,0,0]=4 2750 B14R2.72 Cc1ccc(cc1)OC2CCOC2 34a_100000210336_100000690089 [0,0,1,1,0,0|1,0,0]=3 2751 B14R2.72 Cc1ccc(cc1)OC2CCOC2 7a_100000210336_100000731011 [0,0,1,1,0,0|1,0,0]=3 2752 B14R2.72 Cc1ccc(cc1)SC2CCCC2 62a_100000186775_100000179811 [0,0,1,1,0,0|2,0,0]=4 2753 B14R2.72 Cc1ccc(cc1)SC2CCCC2 62a_100011217020_100000186775 [0,0,1,1,0,0|2,0,0]=4 2754 B14R2.72 Cc1ccc(cc1)SC2CCOC2 62a_100000186775_100000690089 [0,0,1,1,0,0|1,0,0]=3 2755 B14R2.72 Cc1ccc(cn1)OC2CCOC2 34a_100000745506_100000690089 [0,0,1,1,0,0|2,0,0]=4 2756 B14R2.72 Cc1ccc(cn1)OC2CCOC2 7a_100000745506_100000731011 [0,0,1,1,0,0|2,0,0]=4 2757 B14R2.72 Cc1ccc(cn1)SC2CCOC2 62a_100000751577_100000690089 [0,0,1,1,0,0|2,0,0]=4 2758 B14R2.72 Cc1ccc(nc1)OC2CCOC2 34a_100000759353_100000690089 [0,0,1,1,0,0|2,0,0]=4 2759 B14R2.72 Cc1ccc(nc1)SC2CCOC2 62a_100011192072_100000690089 [0,0,1,1,0,0|2,0,0]=4 2760 B14R2.72 Cc1ccc(nn1)N[C@@H]2CCOC2 27a_200015188469_100000744512 [0,0,1,1,0,0|2,0,0]=4 2761 B14R2.72 Cc1ccc(nn1)N[C@H]2CCOC2 27a_100015188467_100000744512 [0,0,1,1,0,0|2,0,0]=4 2762 B14R2.72 Cc1cnc(cn1)N[C@@H]2CCOC2 27a_200015188469_100000074397 [0,0,1,1,0,0|2,0,0]=4 2763 B14R2.72 Cc1cnc(cn1)N[C@H]2CCOC2 27a_100015188467_100000074397 [0,0,1,1,0,0|2,0,0]=4 2764 B14R2.72 Cc1cnc(nc1)N[C@@H]2CCOC2 27a_200015188469_100000061069 [0,0,1,1,0,0|2,0,0]=4 2765 B14R2.72 Cc1cnc(nc1)N[C@H]2CCOC2 27a_100015188467_100000061069 [0,0,1,1,0,0|2,0,0]=4 2766 B14R2.72 Clc1ccc(cc1)NC2CCCC2 2230a_100000210052_100000179811 [0,0,1,1,0,0|2,0,0]=4 2767 B14R2.72 Clc1ccc(cc1)NC2CCCC2 34a_100000210052_100000179811 [0,0,1,1,0,0|2,0,0]=4 2768 B14R2.72 Clc1ccc(cc1)NC2CCOC2 2230a_100000210052_100000731011 [0,0,1,1,0,0|1,0,0]=3 2769 B14R2.72 Clc1ccc(cc1)NC2CCOC2 34a_100000210052_100000690089 [0,0,1,1,0,0|1,0,0]=3 2770 B14R2.72 Clc1ccc(cc1)OC2CCOC2 34a_100000210216_100000690089 [0,0,1,1,0,0|2,0,0]=4 2771 B14R2.72 Clc1ccc(cc1)OC2CCOC2 7a_100000210216_100000731011 [0,0,1,1,0,0|2,0,0]=4 2772 B14R2.72 Clc1ccc(cc1)SC2CCOC2 62a_100000755918_100000690089 [0,0,1,1,0,0|2,0,0]=4 2773 B14R2.72 Fc1ccc(cc1)NC2CCCC2 34a_100000185862_100000179811 [0,0,1,1,0,0|2,0,0]=4 2774 B14R2.72 Fc1ccc(cc1)NC2CCOC2 34a_100000185862_100000690089 [0,0,1,1,0,0|1,0,0]=3 2775 B14R2.72 Fc1ccc(cc1)OC2CCOC2 34a_100000210339_100000690089 [0,0,1,1,0,0|2,0,0]=4 2776 B14R2.72 Fc1ccc(cc1)SC2CCOC2 62a_100000211213_100000690089 [0,0,1,1,0,0|2,0,0]=4 2777 B14R2.72 Ic1ccc(cc1)NC2CCCC2 34a_100000185761_100000179811 [0,0,1,1,0,0|2,0,0]=4 2778 B14R2.72 Ic1ccc(cc1)NC2CCOC2 34a_100000185761_100000690089 [0,0,1,1,0,0|1,0,0]=3 2779 B14R2.72 Ic1ccc(cc1)OC2CCOC2 34a_100000212066_100000690089 [0,0,1,1,0,0|2,0,0]=4 2780 B14R2.72 Ic1ccc(cc1)OC2CCOC2 7a_100000212066_100000731011 [0,0,1,1,0,0|2,0,0]=4 2781 B14R2.72 Nc1ccc(cc1)OC2CCOC2 34a_100000185829_100000690089 [0,0,1,1,0,0|2,0,0]=4 2782 B14R2.72 Nc1ccc(cc1)SC2CCOC2 62a_100000185761_100000690089 [0,0,1,1,0,0|2,0,0]=4 2783 B14R2.72 Oc1ccc(cc1)NC2CCCC2 34a_100000185829_100000179811 [0,0,1,1,0,0|2,0,0]=4 2784 B14R2.72 Oc1ccc(cc1)NC2CCOC2 34a_100000185829_100000690089 [0,0,1,1,0,0|1,0,0]=3 2785 B14R2.947 Cc1ccc(cc1)CN2CC(C2)O 269982a_100000749847_100000210814 [0,0,1,1,0,0|2,0,0]=4 2786 B14R2.947 Cc1ccc(cc1)CN2CC(C2)O 26a_100000749847_200020625495 [0,0,1,1,0,0|2,0,0]=4 2787 B14R2.947 Cc1ccc(nn1)N[C@H]2C[C@@H](C2)O 27a_100020629032_100000744512 [0,0,1,1,0,0|2,0,0]=4 2788 B14R2.947 Cc1cnc(cn1)N[C@H]2C[C@@H](C2)O 27a_100020629032_100000074397 [0,0,1,1,0,0|2,0,0]=4 2789 B14R2.947 Cc1cnc(nc1)N[C@H]2C[C@@H](C2)O 27a_100020629032_100000061069 [0,0,1,1,0,0|2,0,0]=4 2790 B14R2.947 O[C@H]1C[C@@H](C1)Nc2ccc(cn2)Br 27a_100020629032_100000686858 [0,0,1,1,0,0|2,0,0]=4 2791 B14R2.949 Cc1ccc(cc1)NC(=O)C2CO2 11a_100000124888_100000701028 [0,0,1,1,0,0|1,0,1]=4 2792 B14R2.949 Cc1ccc(cc1)NC(=O)C2CO2 1626a_100000124888_100000701028 [0,0,1,1,0,0|1,0,1]=4 2793 B14R2.949 Cc1ccc(cc1)NC(=O)C2CO2 22a_100000124888_100000701028 [0,0,1,1,0,0|1,0,1]=4 2794 B14R2.949 Cc1ccc(cc1)NC(=O)C2CO2 527a_100000124888_100000701028 [0,0,1,1,0,0|1,0,1]=4 2795 B14R2.117 C#Cc1cc(ccc1NC2CC2)C 34a_200012001881_100000211595 [0,0,1,1,0,0|1,0,1]=4 2796 B14R2.117 CCc1cc(ccc1NC2CC2)Br 34a_100000686106_100000211595 [0,0,1,1,0,0|2,0,0]=4 2797 B14R2.117 CCc1cc(ccc1NC2CC2)Cl 34a_100012017146_100000211595 [0,0,1,1,0,0|2,0,0]=4 2798 B14R2.117 CCc1cc(ccc1NC2CC2)I 34a_100000014069_100000211595 [0,0,1,1,0,0|2,0,0]=4 2799 B14R2.117 CCc1cc(ccc1OC2CC2)C 34a_100009844793_100000211595 [0,0,1,1,0,0|2,0,0]=4 2800 B14R2.117 COc1cc(ccc1NC2CC2)C 34a_100000746441_100000211595 [0,0,1,1,0,0|2,0,0]=4 2801 B14R2.117 Cc1cc(c(cn1)SC2CC2)CO 62a_100015579599_100000211595 [0,0,1,1,0,0|2,0,0]=4 2802 B14R2.117 Cc1ccc(c(c1)CO)NC2CC2 34a_100011215565_100000211595 [0,0,1,1,0,0|0,0,0]=2 2803 B14R2.117 Cc1ccc(c(c1)CO)OC2CC2 34a_200011846009_100000211595 [0,0,1,1,0,0|1,0,0]=3 2804 B14R2.117 Cc1ccc(c(c1)CO)SC2CC2 62a_100012361352_100000211595 [0,0,1,1,0,0|1,0,0]=3 2805 B14R2.117 Cc1ccc(c(n1)CO)OC2CC2 34a_100000751967_100000211595 [0,0,1,1,0,0|2,0,0]=4 2806 B14R2.117 Cc1ccc(c(n1)CO)SC2CC2 62a_100010074375_100000211595 [0,0,1,1,0,0|2,0,0]=4 2807 B14R2.117 Cc1cnc(c(c1)CO)SC2CC2 62a_100000118064_100000211595 [0,0,1,1,0,0|2,0,0]=4 2808 B14R2.117 Nc1ccc(c(c1)CO)SC2CC2 62a_100012347228_100000211595 [0,0,1,1,0,0|2,0,0]=4 2809 B14R2.117 OCc1cc(ccc1NC2CC2)Br 34a_100012353972_100000211595 [0,0,1,1,0,0|1,0,0]=3 2810 B14R2.117 OCc1cc(ccc1NC2CC2)Cl 34a_100011214999_100000211595 [0,0,1,1,0,0|1,0,0]=3 2811 B14R2.117 OCc1cc(ccc1NC2CC2)F 34a_100011296978_100000211595 [0,0,1,1,0,0|1,0,0]=3 2812 B14R2.117 OCc1cc(ccc1OC2CC2)Br 34a_100000184703_100000211595 [0,0,1,1,0,0|2,0,0]=4 2813 B14R2.117 OCc1cc(ccc1OC2CC2)Cl 34a_100011218961_100000211595 [0,0,1,1,0,0|2,0,0]=4 2814 B14R2.117 OCc1cc(ccc1OC2CC2)F 34a_100011291448_100000211595 [0,0,1,1,0,0|2,0,0]=4 2815 B14R2.117 OCc1cc(ccc1OC2CC2)I 34a_100000049520_100000211595 [0,0,1,1,0,0|2,0,0]=4 2816 B14R2.117 OCc1cc(ccc1SC2CC2)Br 62a_100011356890_100000211595 [0,0,1,1,0,0|2,0,0]=4 2817 B14R2.117 OCc1cc(ccc1SC2CC2)F 62a_100011217561_100000211595 [0,0,1,1,0,0|2,0,0]=4 2818 B14R2.117 OCc1cc(ccc1SC2CC2)O 62a_100012351483_100000211595 [0,0,1,1,0,0|2,0,0]=4 2819 B14R2.265 CCNc1ccc(cc1C2CC2)I 34a_100010997530_100000210202 [0,0,1,1,0,0|2,0,0]=4 2820 B14R2.265 CCNc1ccc(cc1C2CC2)I 7a_100010997530_100000210202 [0,0,1,1,0,0|2,0,0]=4 2821 B14R2.265 CCOc1ccc(cc1C2CC2)C 271570a_100011220607_200000230997 [0,0,1,1,0,0|2,0,0]=4 2822 B14R2.9205 C[C@H](O)c1cc(ccc1C2CC2)F 271570a_100011220607_100134768474 [0,0,1,1,0,0|2,0,0]=4 2823 B14R2.306 Cc1ccc(c(c1)C2=CCCC2)N 271570a_100000089523_100000210942 [0,0,1,1,0,0|1,0,1]=4 2824 B14R2.30096 C=C(c1cc(ccc1N)C)C2CC2 271570a_100010895485_100000210942 [0,0,1,1,0,0|1,0,1]=4 2825 B12R1.16 CCCN(C)c1ccc(cc1)C 2230a_100000219977_100000210303 [0,0,1,0,1,0|2,0,0]=4 2826 B12R1.16 CCCN(C)c1ccc(cc1)C 269982a_100000219977_100000210303 [0,0,1,0,1,0|2,0,0]=4 2827 B12R1.16 CCCN(C)c1ccc(cc1)C 34a_100000219977_100000210303 [0,0,1,0,1,0|2,0,0]=4 2828 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,0,1,0,1,0|2,0,0]=4 2829 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,0,1,0,1,0|2,0,0]=4 2830 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,0,1,0,1,0|2,0,0]=4 2831 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,0,1,0,1,0|2,0,0]=4 2832 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,0,1,0,1,0|2,0,0]=4 2833 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,0,1,0,1,0|2,0,0]=4 2834 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,0,1,0,1,0|2,0,0]=4 2835 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [0,0,1,0,1,0|2,0,0]=4 2836 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [0,0,1,0,1,0|2,0,0]=4 2837 B12R1.16 CN(CCO)c1ccc(cc1)Br 2230a_100000219623_100000211926 [0,0,1,0,1,0|2,0,0]=4 2838 B12R1.16 CN(CCO)c1ccc(cc1)Br 269982a_100000219623_100000211926 [0,0,1,0,1,0|2,0,0]=4 2839 B12R1.16 CN(CCO)c1ccc(cc1)Br 34a_100000219623_100000211926 [0,0,1,0,1,0|2,0,0]=4 2840 B12R1.16 CN(CCO)c1ccc(cc1)Cl 2230a_100020629279_100000211926 [0,0,1,0,1,0|2,0,0]=4 2841 B12R1.16 CN(CCO)c1ccc(cc1)Cl 269982a_100020629279_100000211926 [0,0,1,0,1,0|2,0,0]=4 2842 B12R1.16 CN(CCO)c1ccc(cc1)Cl 34a_100020629279_100000211926 [0,0,1,0,1,0|2,0,0]=4 2843 B12R1.16 CN(CCO)c1ccc(cc1)F 2230a_100000219829_100000211926 [0,0,1,0,1,0|2,0,0]=4 2844 B12R1.16 CN(CCO)c1ccc(cc1)F 269982a_100000219829_100000211926 [0,0,1,0,1,0|2,0,0]=4 2845 B12R1.16 CN(CCO)c1ccc(cc1)F 34a_100000219829_100000211926 [0,0,1,0,1,0|2,0,0]=4 2846 B12R1.16 CN(CCO)c1ccc(cc1)I 2230a_100000743151_100000211926 [0,0,1,0,1,0|2,0,0]=4 2847 B12R1.16 CN(CCO)c1ccc(cc1)I 269982a_100000743151_100000211926 [0,0,1,0,1,0|2,0,0]=4 2848 B12R1.16 CN(CCO)c1ccc(cc1)I 34a_100000743151_100000211926 [0,0,1,0,1,0|2,0,0]=4 2849 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [0,0,1,0,1,0|2,0,0]=4 2850 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [0,0,1,0,1,0|2,0,0]=4 2851 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [0,0,1,0,1,0|1,0,1]=4 2852 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100011261388_100015361967 [0,0,1,0,1,0|2,0,0]=4 2853 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100015361967_100011261388 [0,0,1,0,1,0|2,0,0]=4 2854 B12R1.16 Cc1ccc(cc1)N(C)CCF 2230a_100000219977_100011217306 [0,0,1,0,1,0|2,0,0]=4 2855 B12R1.16 Cc1ccc(cc1)N(C)CCF 269982a_100000219977_100011217306 [0,0,1,0,1,0|2,0,0]=4 2856 B12R1.16 Cc1ccc(cc1)N(C)CCF 34a_100000219977_100011217306 [0,0,1,0,1,0|2,0,0]=4 2857 B12R1.16 Cc1ccc(cc1)N(C)CCO 2230a_100000219977_100000211926 [0,0,1,0,1,0|1,0,0]=3 2858 B12R1.16 Cc1ccc(cc1)N(C)CCO 269982a_100000219977_100000211926 [0,0,1,0,1,0|1,0,0]=3 2859 B12R1.16 Cc1ccc(cc1)N(C)CCO 34a_100000219977_100000211926 [0,0,1,0,1,0|1,0,0]=3 2860 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCF 34a_100016988085_100015361967 [0,0,1,0,1,0|2,0,0]=4 2861 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,0,1,0,1,0|2,0,0]=4 2862 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,0,1,0,1,0|2,0,0]=4 2863 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [0,0,1,0,1,0|2,0,0]=4 2864 B12R1.31 Cc1cc(cs1)SC(C)CCO 62a_100000759034_100009893172 [0,0,1,0,1,0|2,0,0]=4 2865 B12R1.31 Cc1cc(cs1)SC(C)CCO 62a_100009893172_100000759034 [0,0,1,0,1,0|2,0,0]=4 2866 B12R1.31 Cc1ccc(s1)SC(C)CCO 62a_100000031368_100009893172 [0,0,1,0,1,0|2,0,0]=4 2867 B12R1.31 Cc1ccc(s1)SC(C)CCO 62a_100009893172_100000031368 [0,0,1,0,1,0|2,0,0]=4 2868 B12R1.31 Cc1csc(c1)SC(C)CCO 62a_100009876951_100009893172 [0,0,1,0,1,0|2,0,0]=4 2869 B12R1.31 Cc1csc(c1)SC(C)CCO 62a_100009893172_100009876951 [0,0,1,0,1,0|2,0,0]=4 2870 B12R1.57 C=C(C)c1ccc(cc1CO)C 271570a_100000694244_100012361352 [0,0,1,0,1,0|0,0,2]=4 2871 B12R1.57 COc1cc(ccc1C(C)C)C 34a_100000185798_200000210301 [0,0,1,0,1,0|2,0,0]=4 2872 B12R1.57 COc1cc(ccc1C(C)C)C 7a_100000185798_200000210301 [0,0,1,0,1,0|2,0,0]=4 2873 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 34a_100000185798_200025704644 [0,0,1,0,1,0|2,0,0]=4 2874 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 7a_100000185798_200025704644 [0,0,1,0,1,0|2,0,0]=4 2875 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,0,1,0,1,0|1,0,1]=4 2876 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,0,1,0,1,0|1,0,1]=4 2877 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [1,0,0,0,1,0|1,0,1]=4 2878 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [1,0,0,0,1,0|2,0,0]=4 2879 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [1,0,0,0,1,0|1,0,0]=3 2880 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [1,0,0,0,1,0|2,0,0]=4 2881 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [1,0,0,0,1,0|2,0,0]=4 2882 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [1,0,0,0,1,0|2,0,0]=4 2883 B14R1.502 CC(CCO)NCc1ccc(cc1)Br 2230a_100000174875_100009893172 [0,0,1,0,0,1|1,0,0]=3 2884 B14R1.502 CC(CCO)NCc1ccc(cc1)Br 34a_100000174875_100009893172 [0,0,1,0,0,1|1,0,0]=3 2885 B14R1.502 CC(CCO)NCc1ccc(cc1)Cl 2230a_100000174871_100009893172 [0,0,1,0,0,1|1,0,0]=3 2886 B14R1.502 CC(CCO)NCc1ccc(cc1)Cl 34a_100000174871_100009893172 [0,0,1,0,0,1|1,0,0]=3 2887 B14R1.502 CC(CCO)NCc1ccc(cc1)F 2230a_100000174882_100009893172 [0,0,1,0,0,1|1,0,0]=3 2888 B14R1.502 CC(CCO)NCc1ccc(cc1)F 34a_100000174882_100009893172 [0,0,1,0,0,1|1,0,0]=3 2889 B14R1.502 CC(CCO)NCc1ccc(cc1)I 2230a_100016989417_100009893172 [0,0,1,0,0,1|1,0,0]=3 2890 B14R1.502 CC(CCO)NCc1ccc(cc1)I 34a_100016989417_100009893172 [0,0,1,0,0,1|1,0,0]=3 2891 B14R1.502 CC(CCO)NCc1ccc(cc1)O 34a_100000185549_100009893172 [0,0,1,0,0,1|1,0,0]=3 2892 B14R1.502 CC(CCO)NCc1ccc(cn1)Br 34a_100015188789_100009893172 [0,0,1,0,0,1|2,0,0]=4 2893 B14R1.502 CC(CCO)NCc1ccc(cn1)Cl 34a_100000697193_100009893172 [0,0,1,0,0,1|2,0,0]=4 2894 B14R1.502 CC(CCO)NCc1ccc(cn1)F 34a_100020620131_100009893172 [0,0,1,0,0,1|2,0,0]=4 2895 B14R1.502 CC(CCO)NCc1ccc(nc1)Br 2230a_100009817727_100009893172 [0,0,1,0,0,1|2,0,0]=4 2896 B14R1.502 CC(CCO)NCc1ccc(nc1)Br 34a_100009817727_100009893172 [0,0,1,0,0,1|2,0,0]=4 2897 B14R1.502 CC(CCO)NCc1ccc(nc1)Cl 2230a_100000735879_100009893172 [0,0,1,0,0,1|2,0,0]=4 2898 B14R1.502 CC(CCO)NCc1ccc(nc1)Cl 34a_100000735879_100009893172 [0,0,1,0,0,1|2,0,0]=4 2899 B14R1.502 CC(CCO)NCc1ccc(nc1)F 2230a_100000101913_100009893172 [0,0,1,0,0,1|2,0,0]=4 2900 B14R1.502 CC(CCO)NCc1ccc(nc1)F 34a_100000101913_100009893172 [0,0,1,0,0,1|2,0,0]=4 2901 B14R1.502 CC(CCO)NCc1ccc(nc1)O 2230a_100000757128_100009893172 [0,0,1,0,0,1|2,0,0]=4 2902 B14R1.502 CC(CCO)OCc1cc[n+](cc1)C 34a_100009831711_100009893172 [0,0,1,0,0,1|2,0,0]=4 2903 B14R1.502 CC(CCO)OCc1ccc(cc1)Br 34a_100000695286_100009893172 [0,0,1,0,0,1|2,0,0]=4 2904 B14R1.502 CC(CCO)OCc1ccc(cc1)Cl 34a_100000211118_100009893172 [0,0,1,0,0,1|2,0,0]=4 2905 B14R1.502 CC(CCO)OCc1ccc(cc1)Cl 7a_100000211118_100009893172 [0,0,1,0,0,1|2,0,0]=4 2906 B14R1.502 CC(CCO)OCc1ccc(cc1)F 34a_100000210977_100009893172 [0,0,1,0,0,1|2,0,0]=4 2907 B14R1.502 CC(CCO)OCc1ccc(cc1)F 7a_100000210977_100009893172 [0,0,1,0,0,1|2,0,0]=4 2908 B14R1.502 CC(CCO)OCc1ccc(cc1)I 34a_100000690907_100009893172 [0,0,1,0,0,1|2,0,0]=4 2909 B14R1.502 CC(CCO)OCc1ccc(cc1)I 7a_100000690907_100009893172 [0,0,1,0,0,1|2,0,0]=4 2910 B14R1.502 CC(CCO)OCc1ccc(cc1)N 34a_100011215238_100009893172 [0,0,1,0,0,1|2,0,0]=4 2911 B14R1.502 CC(CCO)SCc1ccc(cc1)Br 62a_100000189115_100009893172 [0,0,1,0,0,1|2,0,0]=4 2912 B14R1.502 CC(CCO)SCc1ccc(cc1)Br 62a_100009893172_100000189115 [0,0,1,0,0,1|2,0,0]=4 2913 B14R1.502 CC(CCO)SCc1ccc(cc1)Cl 62a_100000187161_100009893172 [0,0,1,0,0,1|2,0,0]=4 2914 B14R1.502 CC(CCO)SCc1ccc(cc1)Cl 62a_100009893172_100000187161 [0,0,1,0,0,1|2,0,0]=4 2915 B14R1.502 CC(CCO)SCc1ccc(cc1)F 62a_100000198546_100009893172 [0,0,1,0,0,1|2,0,0]=4 2916 B14R1.502 CC(CCO)SCc1ccc(cc1)F 62a_100009893172_100000187164 [0,0,1,0,0,1|2,0,0]=4 2917 B14R1.502 CC(CCO)SCc1ccc(cc1)I 62a_100000189116_100009893172 [0,0,1,0,0,1|2,0,0]=4 2918 B14R1.502 CC(CCO)SCc1ccc(cc1)I 62a_100009893172_100000189116 [0,0,1,0,0,1|2,0,0]=4 2919 B14R1.502 CCCC(=NNc1ccc(cc1)C)C 4a_100000683527_100000211909 [0,0,1,0,0,1|1,0,1]=4 2920 B14R1.502 CCCC(C)CNc1ccc(cc1)Br 2230a_100000210018_100011216630 [0,0,1,0,0,1|2,0,0]=4 2921 B14R1.502 CCCC(C)CNc1ccc(cc1)Br 34a_100000210018_100011216630 [0,0,1,0,0,1|2,0,0]=4 2922 B14R1.502 CCCC(C)CNc1ccc(cc1)C 34a_100000124888_100011216630 [0,0,1,0,0,1|1,0,0]=3 2923 B14R1.502 CCCC(C)CNc1ccc(cc1)Cl 2230a_100000210052_100011216630 [0,0,1,0,0,1|2,0,0]=4 2924 B14R1.502 CCCC(C)CNc1ccc(cc1)Cl 34a_100000210052_100011216630 [0,0,1,0,0,1|2,0,0]=4 2925 B14R1.502 CCCC(C)CNc1ccc(cc1)F 34a_100000185862_100011216630 [0,0,1,0,0,1|2,0,0]=4 2926 B14R1.502 CCCC(C)CNc1ccc(cc1)I 34a_100000185761_100011216630 [0,0,1,0,0,1|2,0,0]=4 2927 B14R1.502 CCCC(C)CNc1ccc(cc1)O 34a_100000185829_100011216630 [0,0,1,0,0,1|2,0,0]=4 2928 B14R1.502 CCCC(C)COc1ccc(cc1)C 34a_100000210336_100011216630 [0,0,1,0,0,1|2,0,0]=4 2929 B14R1.502 CCCC(C)COc1ccc(cc1)C 7a_100000210336_100011216630 [0,0,1,0,0,1|2,0,0]=4 2930 B14R1.502 CCCC(C)CSc1ccc(cc1)C 62a_100000186775_100011216630 [0,0,1,0,0,1|2,0,0]=4 2931 B14R1.502 CCCC(C)CSc1ccc(cc1)C 62a_100011216630_100000186775 [0,0,1,0,0,1|2,0,0]=4 2932 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 207a_100000741246_100000186029 [0,0,1,0,0,1|2,0,0]=4 2933 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 2230a_100000174875_100000766640 [0,0,1,0,0,1|2,0,0]=4 2934 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 2230a_100000741246_100011217064 [0,0,1,0,0,1|2,0,0]=4 2935 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 270004a_100000174875_100000211909 [0,0,1,0,0,1|2,0,0]=4 2936 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 270004a_100000741246_100000186029 [0,0,1,0,0,1|2,0,0]=4 2937 B14R1.502 CCCC(C)NCc1ccc(cc1)Br 34a_100000174875_100000766640 [0,0,1,0,0,1|2,0,0]=4 2938 B14R1.502 CCCC(C)NCc1ccc(cc1)C 207a_100000741246_100000211033 [0,0,1,0,0,1|1,0,0]=3 2939 B14R1.502 CCCC(C)NCc1ccc(cc1)C 2230a_100000174908_100000766640 [0,0,1,0,0,1|1,0,0]=3 2940 B14R1.502 CCCC(C)NCc1ccc(cc1)C 2230a_100000741246_100000210814 [0,0,1,0,0,1|1,0,0]=3 2941 B14R1.502 CCCC(C)NCc1ccc(cc1)C 270004a_100000174908_100000211909 [0,0,1,0,0,1|1,0,0]=3 2942 B14R1.502 CCCC(C)NCc1ccc(cc1)C 270004a_100000741246_100000211033 [0,0,1,0,0,1|1,0,0]=3 2943 B14R1.502 CCCC(C)NCc1ccc(cc1)C 34a_100000174908_100000766640 [0,0,1,0,0,1|1,0,0]=3 2944 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 207a_100000741246_100000189385 [0,0,1,0,0,1|2,0,0]=4 2945 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000766640 [0,0,1,0,0,1|2,0,0]=4 2946 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 2230a_100000741246_100000694040 [0,0,1,0,0,1|2,0,0]=4 2947 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 270004a_100000174871_100000211909 [0,0,1,0,0,1|2,0,0]=4 2948 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 270004a_100000741246_100000189385 [0,0,1,0,0,1|2,0,0]=4 2949 B14R1.502 CCCC(C)NCc1ccc(cc1)Cl 34a_100000174871_100000766640 [0,0,1,0,0,1|2,0,0]=4 2950 B14R1.502 CCCC(C)NCc1ccc(cc1)F 207a_100000741246_100000210084 [0,0,1,0,0,1|2,0,0]=4 2951 B14R1.502 CCCC(C)NCc1ccc(cc1)F 2230a_100000174882_100000766640 [0,0,1,0,0,1|2,0,0]=4 2952 B14R1.502 CCCC(C)NCc1ccc(cc1)F 2230a_100000741246_100000198546 [0,0,1,0,0,1|2,0,0]=4 2953 B14R1.502 CCCC(C)NCc1ccc(cc1)F 270004a_100000174882_100000211909 [0,0,1,0,0,1|2,0,0]=4 2954 B14R1.502 CCCC(C)NCc1ccc(cc1)F 270004a_100000741246_100000210084 [0,0,1,0,0,1|2,0,0]=4 2955 B14R1.502 CCCC(C)NCc1ccc(cc1)F 34a_100000174882_100000766640 [0,0,1,0,0,1|2,0,0]=4 2956 B14R1.502 CCCC(C)NCc1ccc(cc1)I 207a_100000741246_100000188517 [0,0,1,0,0,1|2,0,0]=4 2957 B14R1.502 CCCC(C)NCc1ccc(cc1)I 2230a_100000741246_100000189116 [0,0,1,0,0,1|2,0,0]=4 2958 B14R1.502 CCCC(C)NCc1ccc(cc1)I 2230a_100016989417_100000766640 [0,0,1,0,0,1|2,0,0]=4 2959 B14R1.502 CCCC(C)NCc1ccc(cc1)I 270004a_100016989417_100000211909 [0,0,1,0,0,1|2,0,0]=4 2960 B14R1.502 CCCC(C)NCc1ccc(cc1)I 34a_100016989417_100000766640 [0,0,1,0,0,1|2,0,0]=4 2961 B14R1.502 CCCC(C)NCc1ccc(cc1)O 34a_100000185549_100000766640 [0,0,1,0,0,1|2,0,0]=4 2962 B14R1.502 CCCC(C)NCc1ccc(cn1)C 207a_100000741246_100000050478 [0,0,1,0,0,1|2,0,0]=4 2963 B14R1.502 CCCC(C)NCc1ccc(cn1)C 2230a_100000741246_100000691093 [0,0,1,0,0,1|2,0,0]=4 2964 B14R1.502 CCCC(C)NCc1ccc(cn1)C 270004a_100000741246_100000050478 [0,0,1,0,0,1|2,0,0]=4 2965 B14R1.502 CCCC(C)NCc1ccc(cn1)C 34a_100015187455_100000766640 [0,0,1,0,0,1|2,0,0]=4 2966 B14R1.502 CCCC(C)NCc1ccc(nc1)C 2230a_100000741246_100016987292 [0,0,1,0,0,1|2,0,0]=4 2967 B14R1.502 CCCC(C)NCc1ccc(nc1)C 270004a_100000740942_100000211909 [0,0,1,0,0,1|2,0,0]=4 2968 B14R1.502 CCCC(C)NCc1ccc(nc1)C 270004a_100000741246_100000743784 [0,0,1,0,0,1|2,0,0]=4 2969 B14R1.502 CCCC(C)NCc1ccc(nc1)C 34a_100000740942_100000766640 [0,0,1,0,0,1|2,0,0]=4 2970 B14R1.502 CCCC(C)OCc1ccc(cc1)C 34a_100000764384_100000210814 [0,0,1,0,0,1|2,0,0]=4 2971 B14R1.502 CCCC(C)OCc1ccc(cc1)C 34a_100011215236_100000766640 [0,0,1,0,0,1|2,0,0]=4 2972 B14R1.502 CCCC(C)OCc1ccc(cc1)C 7a_100000764384_100000210814 [0,0,1,0,0,1|2,0,0]=4 2973 B14R1.502 CCCC(C)OCc1ccc(cc1)C 7a_100011215236_100000766640 [0,0,1,0,0,1|2,0,0]=4 2974 B14R1.502 CCCC(C)SCc1ccc(cc1)C 62a_100000210814_100000766640 [0,0,1,0,0,1|2,0,0]=4 2975 B14R1.502 CCCC(C)SCc1ccc(cc1)C 62a_100000766640_100000210814 [0,0,1,0,0,1|2,0,0]=4 2976 B14R1.502 COCC(C)NCc1ccc(cc1)C 2230a_100000174908_100000765312 [0,0,1,0,0,1|2,0,0]=4 2977 B14R1.502 COCC(C)NCc1ccc(cc1)C 270004a_100000174908_100000749346 [0,0,1,0,0,1|2,0,0]=4 2978 B14R1.502 COCC(C)NCc1ccc(cc1)C 34a_100000174908_100000765312 [0,0,1,0,0,1|2,0,0]=4 2979 B14R1.502 COC[C@@H](C)NCc1ccc(cc1)C 207a_100000764878_100000211033 [0,0,1,0,0,1|2,0,0]=4 2980 B14R1.502 COC[C@@H](C)NCc1ccc(cc1)C 2230a_100000764878_100000210814 [0,0,1,0,0,1|2,0,0]=4 2981 B14R1.502 COC[C@@H](C)NCc1ccc(cc1)C 270004a_100000764878_100000211033 [0,0,1,0,0,1|2,0,0]=4 2982 B14R1.502 CSCC(C)NCc1ccc(cc1)C 270004a_100000174908_100011216314 [0,0,1,0,0,1|2,0,0]=4 2983 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Br 207a_100000706166_100000186029 [0,0,1,0,0,1|1,0,0]=3 2984 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Br 2230a_100000706166_100011217064 [0,0,1,0,0,1|1,0,0]=3 2985 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Br 270004a_100000706166_100000186029 [0,0,1,0,0,1|1,0,0]=3 2986 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Br 34a_100000706166_100000189115 [0,0,1,0,0,1|1,0,0]=3 2987 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Cl 207a_100000706166_100000189385 [0,0,1,0,0,1|1,0,0]=3 2988 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Cl 2230a_100000706166_100000694040 [0,0,1,0,0,1|1,0,0]=3 2989 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Cl 270004a_100000706166_100000189385 [0,0,1,0,0,1|1,0,0]=3 2990 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)Cl 34a_100000706166_100000694040 [0,0,1,0,0,1|1,0,0]=3 2991 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)F 207a_100000706166_100000210084 [0,0,1,0,0,1|1,0,0]=3 2992 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)F 2230a_100000706166_100000198546 [0,0,1,0,0,1|1,0,0]=3 2993 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)F 270004a_100000706166_100000210084 [0,0,1,0,0,1|1,0,0]=3 2994 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)F 34a_100000706166_100000198546 [0,0,1,0,0,1|1,0,0]=3 2995 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)I 207a_100000706166_100000188517 [0,0,1,0,0,1|1,0,0]=3 2996 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)I 2230a_100000706166_100000189116 [0,0,1,0,0,1|1,0,0]=3 2997 B14R1.502 C[C@H](CCO)NCc1ccc(cc1)I 34a_100000706166_100000189116 [0,0,1,0,0,1|1,0,0]=3 2998 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Br 207a_100000706166_100000754260 [0,0,1,0,0,1|2,0,0]=4 2999 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Br 2230a_100000706166_100000702658 [0,0,1,0,0,1|2,0,0]=4 3000 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Br 270004a_100000706166_100000754260 [0,0,1,0,0,1|2,0,0]=4 3001 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Br 34a_100000706166_100000702658 [0,0,1,0,0,1|2,0,0]=4 3002 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Cl 207a_100000706166_100011361569 [0,0,1,0,0,1|2,0,0]=4 3003 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Cl 2230a_100000706166_100012066911 [0,0,1,0,0,1|2,0,0]=4 3004 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Cl 270004a_100000706166_100011361569 [0,0,1,0,0,1|2,0,0]=4 3005 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)Cl 34a_100000706166_100012066911 [0,0,1,0,0,1|2,0,0]=4 3006 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)F 207a_100000706166_100011934744 [0,0,1,0,0,1|2,0,0]=4 3007 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)F 2230a_100000706166_100000703193 [0,0,1,0,0,1|2,0,0]=4 3008 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)F 270004a_100000706166_100011934744 [0,0,1,0,0,1|2,0,0]=4 3009 B14R1.502 C[C@H](CCO)NCc1ccc(cn1)F 34a_100000706166_100000703193 [0,0,1,0,0,1|2,0,0]=4 3010 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)Br 2230a_100000706166_100009831999 [0,0,1,0,0,1|2,0,0]=4 3011 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)Br 34a_100000706166_100009831999 [0,0,1,0,0,1|2,0,0]=4 3012 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)Cl 2230a_100000706166_100000735431 [0,0,1,0,0,1|2,0,0]=4 3013 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)Cl 34a_100000706166_100000735431 [0,0,1,0,0,1|2,0,0]=4 3014 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)F 2230a_100000706166_100009820150 [0,0,1,0,0,1|2,0,0]=4 3015 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)F 34a_100000706166_100000099788 [0,0,1,0,0,1|2,0,0]=4 3016 B14R1.502 C[C@H](CCO)NCc1ccc(nc1)O 207a_100000706166_100011361521 [0,0,1,0,0,1|2,0,0]=4 3017 B14R1.502 Cc1ccc(cc1)CCN(C)CCO 2230a_100000210263_100011713686 [0,0,1,0,0,1|2,0,0]=4 3018 B14R1.502 Cc1ccc(cc1)CCN(C)CCO 269982a_100000210263_100011713686 [0,0,1,0,0,1|2,0,0]=4 3019 B14R1.502 Cc1ccc(cc1)CNC(=O)CCO 240690a_100000174908_100011216618 [0,0,1,0,0,1|1,0,1]=4 3020 B14R1.502 Cc1ccc(cc1)CNC(C)CC#N 2230a_100000174908_100009813641 [0,0,1,0,0,1|1,0,1]=4 3021 B14R1.502 Cc1ccc(cc1)CNC(C)CCO 2230a_100000174908_100009893172 [0,0,1,0,0,1|0,0,0]=2 3022 B14R1.502 Cc1ccc(cc1)CNC(C)CCO 34a_100000174908_100009893172 [0,0,1,0,0,1|0,0,0]=2 3023 B14R1.502 Cc1ccc(cc1)CN[C@@H](C)CC#N 207a_100016994482_100000211033 [0,0,1,0,0,1|1,0,1]=4 3024 B14R1.502 Cc1ccc(cc1)CN[C@@H](C)CC#N 2230a_100016994482_100000210814 [0,0,1,0,0,1|1,0,1]=4 3025 B14R1.502 Cc1ccc(cc1)CN[C@H](C)CCO 207a_100000706166_100000211033 [0,0,1,0,0,1|0,0,0]=2 3026 B14R1.502 Cc1ccc(cc1)CN[C@H](C)CCO 2230a_100000706166_100000210814 [0,0,1,0,0,1|0,0,0]=2 3027 B14R1.502 Cc1ccc(cc1)CN[C@H](C)CCO 270004a_100000706166_100000211033 [0,0,1,0,0,1|0,0,0]=2 3028 B14R1.502 Cc1ccc(cc1)CN[C@H](C)CCO 34a_100000706166_100000210814 [0,0,1,0,0,1|0,0,0]=2 3029 B14R1.502 Cc1ccc(cc1)COC(C)CCBr 34a_100012276601_100000210814 [0,0,1,0,0,1|2,0,0]=4 3030 B14R1.502 Cc1ccc(cc1)COC(C)CCO 34a_100011215236_100009893172 [0,0,1,0,0,1|1,0,0]=3 3031 B14R1.502 Cc1ccc(cc1)COC(C)CCO 7a_100011215236_100009893172 [0,0,1,0,0,1|1,0,0]=3 3032 B14R1.502 Cc1ccc(cc1)CSC(C)CCO 62a_100000210814_100009893172 [0,0,1,0,0,1|1,0,0]=3 3033 B14R1.502 Cc1ccc(cc1)CSC(C)CCO 62a_100009893172_100000210814 [0,0,1,0,0,1|1,0,0]=3 3034 B14R1.502 Cc1ccc(cc1)NNC(=O)CCO 22a_100000683527_100011216618 [0,0,1,0,0,1|1,0,1]=4 3035 B14R1.502 Cc1ccc(cn1)CNC(C)CCO 34a_100000740942_100009893172 [0,0,1,0,0,1|1,0,0]=3 3036 B14R1.502 Cc1ccc(cn1)CN[C@H](C)CCO 2230a_100000706166_100016987292 [0,0,1,0,0,1|1,0,0]=3 3037 B14R1.502 Cc1ccc(cn1)CN[C@H](C)CCO 270004a_100000706166_100000743784 [0,0,1,0,0,1|1,0,0]=3 3038 B14R1.502 Cc1ccc(cn1)CN[C@H](C)CCO 34a_100000706166_100016987292 [0,0,1,0,0,1|1,0,0]=3 3039 B14R1.502 Cc1ccc(cn1)COC(C)CCO 34a_100011248133_100009893172 [0,0,1,0,0,1|2,0,0]=4 3040 B14R1.502 Cc1ccc(cn1)CSC(C)CCO 62a_100009893172_100016987292 [0,0,1,0,0,1|2,0,0]=4 3041 B14R1.502 Cc1ccc(cn1)CSC(C)CCO 62a_100016987292_100009893172 [0,0,1,0,0,1|2,0,0]=4 3042 B14R1.502 Cc1ccc(nc1)CNC(C)CCO 34a_100015187455_100009893172 [0,0,1,0,0,1|1,0,0]=3 3043 B14R1.502 Cc1ccc(nc1)CN[C@H](C)CCO 207a_100000706166_100000050478 [0,0,1,0,0,1|1,0,0]=3 3044 B14R1.502 Cc1ccc(nc1)CN[C@H](C)CCO 2230a_100000706166_100000691093 [0,0,1,0,0,1|1,0,0]=3 3045 B14R1.502 Cc1ccc(nc1)CN[C@H](C)CCO 270004a_100000706166_100000050478 [0,0,1,0,0,1|1,0,0]=3 3046 B14R1.502 Cc1ccc(nc1)CN[C@H](C)CCO 34a_100000706166_100000691093 [0,0,1,0,0,1|1,0,0]=3 3047 B14R1.502 Cc1ccc(nc1)COC(C)CCO 34a_100012001401_100009893172 [0,0,1,0,0,1|2,0,0]=4 3048 B14R1.502 Cc1ccc(nc1)CSC(C)CCO 62a_100000691093_100009893172 [0,0,1,0,0,1|2,0,0]=4 3049 B14R1.502 Cc1ccc(nc1)CSC(C)CCO 62a_100009893172_100000691093 [0,0,1,0,0,1|2,0,0]=4 3050 B14R1.502 Cc1cnc(cn1)CNC(C)CCO 34a_100132314150_100009893172 [0,0,1,0,0,1|2,0,0]=4 3051 B14R1.502 Cc1cnc(cn1)CN[C@H](C)CCO 2230a_100000706166_100000752025 [0,0,1,0,0,1|2,0,0]=4 3052 B14R1.502 Cc1cnc(cn1)CN[C@H](C)CCO 270004a_100000706166_100000685221 [0,0,1,0,0,1|2,0,0]=4 3053 B14R1.502 Cc1cnc(nc1)CN[C@H](C)CCO 2230a_100000706166_100000685645 [0,0,1,0,0,1|2,0,0]=4 3054 B14R1.502 Cc1cnc(nc1)CN[C@H](C)CCO 34a_100000706166_100000685645 [0,0,1,0,0,1|2,0,0]=4 3055 B14R1.502 Cc1ncc(cn1)CN[C@H](C)CCO 270004a_100000706166_100011202771 [0,0,1,0,0,1|2,0,0]=4 3056 B14R1.1600 C#Cc1cc(ccc1NCC(C)C)C 34a_200012001881_100000210624 [0,0,1,0,0,1|1,0,1]=4 3057 B14R1.1600 C=C(C)CNc1ccc(cc1CO)C 34a_100011215565_100000748629 [0,0,1,0,0,1|0,0,2]=4 3058 B14R1.1600 CC(C)C=Cc1ccc(cc1CO)Br 271570a_100016257149_100011356890 [0,0,1,0,0,1|2,0,0]=4 3059 B14R1.1600 CC(C)C=Cc1ccc(cc1CO)F 271570a_100016257149_100011217561 [0,0,1,0,0,1|2,0,0]=4 3060 B14R1.1600 CC(C)C=Cc1ccc(cc1CO)N 271570a_100016257149_100012347228 [0,0,1,0,0,1|2,0,0]=4 3061 B14R1.1600 CC(C)C=Cc1ccc(cc1CO)O 271570a_100016257149_100012351483 [0,0,1,0,0,1|2,0,0]=4 3062 B14R1.1600 CC(C)CNc1ccc(cc1CO)Br 34a_100012353972_100000210624 [0,0,1,0,0,1|1,0,0]=3 3063 B14R1.1600 CC(C)CNc1ccc(cc1CO)Cl 34a_100011214999_100000210624 [0,0,1,0,0,1|1,0,0]=3 3064 B14R1.1600 CC(C)CNc1ccc(cc1CO)F 34a_100011296978_100000210624 [0,0,1,0,0,1|1,0,0]=3 3065 B14R1.1600 CC(C)COc1ccc(cc1CO)Br 34a_100000184703_100000210624 [0,0,1,0,0,1|2,0,0]=4 3066 B14R1.1600 CC(C)COc1ccc(cc1CO)Br 7a_100000184703_100000210760 [0,0,1,0,0,1|2,0,0]=4 3067 B14R1.1600 CC(C)COc1ccc(cc1CO)Cl 34a_100011218961_100000210624 [0,0,1,0,0,1|2,0,0]=4 3068 B14R1.1600 CC(C)COc1ccc(cc1CO)Cl 7a_100011218961_100000210760 [0,0,1,0,0,1|2,0,0]=4 3069 B14R1.1600 CC(C)COc1ccc(cc1CO)F 34a_100011291448_100000210624 [0,0,1,0,0,1|2,0,0]=4 3070 B14R1.1600 CC(C)COc1ccc(cc1CO)F 7a_100011291448_100000210760 [0,0,1,0,0,1|2,0,0]=4 3071 B14R1.1600 CC(C)COc1ccc(cc1CO)I 34a_100000049520_100000210624 [0,0,1,0,0,1|2,0,0]=4 3072 B14R1.1600 CC(C)COc1ccc(cc1CO)I 7a_100000049520_100000210760 [0,0,1,0,0,1|2,0,0]=4 3073 B14R1.1600 CC(C)CSc1ccc(cc1CO)Br 62a_100000210624_100011356890 [0,0,1,0,0,1|2,0,0]=4 3074 B14R1.1600 CC(C)CSc1ccc(cc1CO)Br 62a_100011356890_100000210760 [0,0,1,0,0,1|2,0,0]=4 3075 B14R1.1600 CC(C)CSc1ccc(cc1CO)F 62a_100000210624_100011217561 [0,0,1,0,0,1|2,0,0]=4 3076 B14R1.1600 CC(C)CSc1ccc(cc1CO)F 62a_100011217561_100000210760 [0,0,1,0,0,1|2,0,0]=4 3077 B14R1.1600 CC(C)CSc1ccc(cc1CO)N 62a_100000210624_100012347228 [0,0,1,0,0,1|2,0,0]=4 3078 B14R1.1600 CC(C)CSc1ccc(cc1CO)N 62a_100012347228_100000210760 [0,0,1,0,0,1|2,0,0]=4 3079 B14R1.1600 CC(C)CSc1ccc(cc1CO)O 62a_100000210624_100012351483 [0,0,1,0,0,1|2,0,0]=4 3080 B14R1.1600 CC(C)CSc1ccc(cc1CO)O 62a_100012351483_100000210760 [0,0,1,0,0,1|2,0,0]=4 3081 B14R1.1600 CC(O)CNc1ccc(cc1CO)Br 34a_100012353972_100011218427 [0,0,1,0,0,1|2,0,0]=4 3082 B14R1.1600 CC(O)CNc1ccc(cc1CO)Cl 34a_100011214999_100011218427 [0,0,1,0,0,1|2,0,0]=4 3083 B14R1.1600 CC(O)CNc1ccc(cc1CO)F 34a_100011296978_100011218427 [0,0,1,0,0,1|2,0,0]=4 3084 B14R1.1600 CCc1cc(ccc1CNC(C)C)Br 207a_100138425928_100010209654 [0,0,1,0,0,1|2,0,0]=4 3085 B14R1.1600 CCc1cc(ccc1NCC(C)C)Br 2230a_100000686106_100000210760 [0,0,1,0,0,1|2,0,0]=4 3086 B14R1.1600 CCc1cc(ccc1NCC(C)C)Br 34a_100000686106_100000210624 [0,0,1,0,0,1|2,0,0]=4 3087 B14R1.1600 CCc1cc(ccc1NCC(C)C)Br 7a_100000686106_100000210760 [0,0,1,0,0,1|2,0,0]=4 3088 B14R1.1600 CCc1cc(ccc1NCC(C)C)Cl 2230a_100012017146_100000210760 [0,0,1,0,0,1|2,0,0]=4 3089 B14R1.1600 CCc1cc(ccc1NCC(C)C)Cl 34a_100012017146_100000210624 [0,0,1,0,0,1|2,0,0]=4 3090 B14R1.1600 CCc1cc(ccc1NCC(C)C)Cl 7a_100012017146_100000210760 [0,0,1,0,0,1|2,0,0]=4 3091 B14R1.1600 CCc1cc(ccc1NCC(C)C)I 2230a_100000014069_100000210760 [0,0,1,0,0,1|2,0,0]=4 3092 B14R1.1600 CCc1cc(ccc1NCC(C)C)I 34a_100000014069_100000210624 [0,0,1,0,0,1|2,0,0]=4 3093 B14R1.1600 CCc1cc(ccc1NCC(C)C)I 7a_100000014069_100000210760 [0,0,1,0,0,1|2,0,0]=4 3094 B14R1.1600 CCc1cc(ccc1OCC(C)C)C 34a_100009844793_100000210624 [0,0,1,0,0,1|2,0,0]=4 3095 B14R1.1600 CCc1cc(ccc1OCC(C)C)C 7a_100009844793_100000210760 [0,0,1,0,0,1|2,0,0]=4 3096 B14R1.1600 COc1cc(ccc1CNC(C)C)C 207a_100138425928_100000689369 [0,0,1,0,0,1|2,0,0]=4 3097 B14R1.1600 COc1cc(ccc1NCC(C)C)C 2230a_100000746441_100000210760 [0,0,1,0,0,1|2,0,0]=4 3098 B14R1.1600 COc1cc(ccc1NCC(C)C)C 34a_100000746441_100000210624 [0,0,1,0,0,1|2,0,0]=4 3099 B14R1.1600 C[C@@H](O)CNc1ccc(cc1CO)Br 34a_100012353972_100009817552 [0,0,1,0,0,1|2,0,0]=4 3100 B14R1.1600 C[C@@H](O)CNc1ccc(cc1CO)Cl 34a_100011214999_100009817552 [0,0,1,0,0,1|2,0,0]=4 3101 B14R1.1600 C[C@@H](O)CNc1ccc(cc1CO)F 34a_100011296978_100009817552 [0,0,1,0,0,1|2,0,0]=4 3102 B14R1.1600 Cc1cc(c(cn1)C=CC(C)C)CO 271570a_100016257149_100015579599 [0,0,1,0,0,1|2,0,0]=4 3103 B14R1.1600 Cc1cc(c(cn1)SCC(C)C)CO 62a_100000210624_100015579599 [0,0,1,0,0,1|2,0,0]=4 3104 B14R1.1600 Cc1cc(c(cn1)SCC(C)C)CO 62a_100015579599_100000210760 [0,0,1,0,0,1|2,0,0]=4 3105 B14R1.1600 Cc1ccc(c(c1)C#N)NCC(C)C 7a_100011934023_100000210760 [0,0,1,0,0,1|1,0,1]=4 3106 B14R1.1600 Cc1ccc(c(c1)CO)C=CC(C)C 271570a_100016257149_100012361352 [0,0,1,0,0,1|1,0,0]=3 3107 B14R1.1600 Cc1ccc(c(c1)CO)C=CC(C)O 271570a_200011019289_100012361352 [0,0,1,0,0,1|2,0,0]=4 3108 B14R1.1600 Cc1ccc(c(c1)CO)NCC(C)C 34a_100011215565_100000210624 [0,0,1,0,0,1|0,0,0]=2 3109 B14R1.1600 Cc1ccc(c(c1)CO)NCC(C)O 34a_100011215565_100011218427 [0,0,1,0,0,1|1,0,0]=3 3110 B14R1.1600 Cc1ccc(c(c1)CO)NCC(F)F 34a_100011215565_100011934356 [0,0,1,0,0,1|2,0,0]=4 3111 B14R1.1600 Cc1ccc(c(c1)CO)NC[C@@H](C)O 34a_100011215565_100009817552 [0,0,1,0,0,1|1,0,0]=3 3112 B14R1.1600 Cc1ccc(c(c1)CO)OCC(C)C 34a_200011846009_100000210624 [0,0,1,0,0,1|1,0,0]=3 3113 B14R1.1600 Cc1ccc(c(c1)CO)OCC(C)C 7a_200011846009_100000210760 [0,0,1,0,0,1|1,0,0]=3 3114 B14R1.1600 Cc1ccc(c(c1)CO)OCC(C)O 34a_200011846009_100011218427 [0,0,1,0,0,1|2,0,0]=4 3115 B14R1.1600 Cc1ccc(c(c1)CO)OCC(C)O 7a_200011846009_100011218427 [0,0,1,0,0,1|2,0,0]=4 3116 B14R1.1600 Cc1ccc(c(c1)CO)OC[C@@H](C)O 34a_200011846009_100009817552 [0,0,1,0,0,1|2,0,0]=4 3117 B14R1.1600 Cc1ccc(c(c1)CO)OC[C@@H](C)O 7a_200011846009_100009817552 [0,0,1,0,0,1|2,0,0]=4 3118 B14R1.1600 Cc1ccc(c(c1)CO)SCC(C)C 62a_100000210624_100012361352 [0,0,1,0,0,1|1,0,0]=3 3119 B14R1.1600 Cc1ccc(c(c1)CO)SCC(C)C 62a_100012361352_100000210760 [0,0,1,0,0,1|1,0,0]=3 3120 B14R1.1600 Cc1ccc(c(c1)CO)SCC(C)O 62a_100011218427_100012361352 [0,0,1,0,0,1|2,0,0]=4 3121 B14R1.1600 Cc1ccc(c(c1)CO)SCC(C)O 62a_100012361352_100011218427 [0,0,1,0,0,1|2,0,0]=4 3122 B14R1.1600 Cc1ccc(c(c1)CO)SC[C@@H](C)O 62a_100009817552_100012361352 [0,0,1,0,0,1|2,0,0]=4 3123 B14R1.1600 Cc1ccc(c(c1)CO)SC[C@@H](C)O 62a_100012361352_100009817552 [0,0,1,0,0,1|2,0,0]=4 3124 B14R1.1600 Cc1ccc(c(n1)CO)C=CC(C)C 271570a_100016257149_100010074375 [0,0,1,0,0,1|2,0,0]=4 3125 B14R1.1600 Cc1ccc(c(n1)CO)OCC(C)C 34a_100000751967_100000210624 [0,0,1,0,0,1|2,0,0]=4 3126 B14R1.1600 Cc1ccc(c(n1)CO)SCC(C)C 62a_100000210624_100010074375 [0,0,1,0,0,1|2,0,0]=4 3127 B14R1.1600 Cc1ccc(c(n1)CO)SCC(C)C 62a_100010074375_100000210760 [0,0,1,0,0,1|2,0,0]=4 3128 B14R1.1600 Cc1cnc(c(c1)CO)C=CC(C)C 271570a_100016257149_100000118064 [0,0,1,0,0,1|2,0,0]=4 3129 B14R1.1600 Cc1cnc(c(c1)CO)SCC(C)C 62a_100000118064_100000210760 [0,0,1,0,0,1|2,0,0]=4 3130 B14R1.1600 Cc1cnc(c(c1)CO)SCC(C)C 62a_100000210624_100000118064 [0,0,1,0,0,1|2,0,0]=4 3131 B14R1.6721 CCNc1ccc(cc1OC(C)C)F 2230a_100000698198_100000210202 [0,0,1,0,0,1|2,0,0]=4 3132 B14R1.6721 CCNc1ccc(cc1OC(C)C)F 34a_100000698198_100000210202 [0,0,1,0,0,1|2,0,0]=4 3133 B14R1.6721 CCNc1ccc(cc1OC(C)C)F 7a_100000698198_100000210202 [0,0,1,0,0,1|2,0,0]=4 3134 B14R1.6721 CCNc1ccc(cc1OC(F)F)C 2230a_100011220573_100000210202 [0,0,1,0,0,1|2,0,0]=4 3135 B14R1.6721 CCNc1ccc(cc1OC(F)F)C 34a_100011220573_100000210202 [0,0,1,0,0,1|2,0,0]=4 3136 B14R1.6721 CCOc1ccc(cc1NC(C)C)C 2230a_100011202655_100000210206 [0,0,1,0,0,1|2,0,0]=4 3137 B14R1.6721 CCOc1ccc(cc1NC(C)C)C 34a_100011202655_100000210206 [0,0,1,0,0,1|2,0,0]=4 3138 B14R1.6721 CCOc1ccc(cc1SC(C)C)C 62a_100000210206_200000230997 [0,0,1,0,0,1|2,0,0]=4 3139 B14R1.6721 CCOc1ccc(cc1SC(C)C)C 62a_200000230997_100000210206 [0,0,1,0,0,1|2,0,0]=4 3140 B14R1.149 CC(C)NCC(O)c1cccc(c1)O 2230a_100020657549_100000210206 [0,0,1,0,0,1|2,0,0]=4 3141 B14R1.149 CC(C)NCC(O)c1cccc(c1)O 34a_100020657549_100000210206 [0,0,1,0,0,1|2,0,0]=4 3142 B14R1.149 Cc1cccc(c1)C(C)NCC(C)C 269862a_100000210953_100000211476 [0,0,1,0,0,1|2,0,0]=4 3143 B14R1.149 Cc1cccc(c1)C(C)NCC(C)O 269862a_100000210904_100000211476 [0,0,1,0,0,1|2,0,0]=4 3144 B14R1.149 Cc1cccc(c1)C(C)OCC(C)C 34a_100000757818_100000210624 [0,0,1,0,0,1|2,0,0]=4 3145 B14R1.149 Cc1cccc(c1)C(C)OCC(C)C 7a_100000757818_100000210760 [0,0,1,0,0,1|2,0,0]=4 3146 B14R1.149 Cc1cccc(c1)C(C)OCC(C)O 34a_100000757818_100011218427 [0,0,1,0,0,1|2,0,0]=4 3147 B14R1.149 Cc1cccc(c1)C(C)OCC(C)O 7a_100000757818_100011218427 [0,0,1,0,0,1|2,0,0]=4 3148 B14R1.149 Cc1cccc(c1)C(C)OC[C@@H](C)O 34a_100000757818_100009817552 [0,0,1,0,0,1|2,0,0]=4 3149 B14R1.149 Cc1cccc(c1)C(C)OC[C@@H](C)O 7a_100000757818_100009817552 [0,0,1,0,0,1|2,0,0]=4 3150 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 2230a_100000698126_100000210760 [0,0,1,0,0,1|2,0,0]=4 3151 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 270004a_100000698126_100000210432 [0,0,1,0,0,1|2,0,0]=4 3152 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 34a_100000698126_100000210624 [0,0,1,0,0,1|2,0,0]=4 3153 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)O 2230a_100000698126_100011218427 [0,0,1,0,0,1|2,0,0]=4 3154 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)O 34a_100000698126_100011218427 [0,0,1,0,0,1|2,0,0]=4 3155 B14R1.149 Cc1cccc(c1)[C@@H](C)NC[C@@H](C)O 2230a_100000698126_100009817552 [0,0,1,0,0,1|2,0,0]=4 3156 B14R1.149 Cc1cccc(c1)[C@@H](C)NC[C@@H](C)O 34a_100000698126_100009817552 [0,0,1,0,0,1|2,0,0]=4 3157 B14R1.149 Cc1cccc(c1)[C@H](N)COC(C)C 34a_100009818812_100000210206 [0,0,1,0,0,1|2,0,0]=4 3158 B14R1.5978 Cc1cccc(c1)NC(C)CC(C)C 2230a_100000188690_100000731052 [0,0,1,0,0,1|2,0,0]=4 3159 B14R1.5978 Cc1cccc(c1)NC(C)CC(C)C 34a_100000188690_100000731052 [0,0,1,0,0,1|2,0,0]=4 3160 B14R1.5978 Cc1cccc(c1)OC(C)CC(C)C 34a_100000210337_100000731052 [0,0,1,0,0,1|2,0,0]=4 3161 B14R1.5978 Cc1cccc(c1)OC(C)CC(C)C 7a_100000210337_100000731052 [0,0,1,0,0,1|2,0,0]=4 3162 B14R1.5978 Cc1cccc(c1)SC(C)CC(C)C 62a_100000731052_100011215228 [0,0,1,0,0,1|2,0,0]=4 3163 B14R1.5978 Cc1cccc(c1)SC(C)CC(C)C 62a_100011215228_100000731052 [0,0,1,0,0,1|2,0,0]=4 3164 B14R1.950 CCCC(C)Nc1cc(ccc1Br)C 34a_100000745044_100000766640 [0,0,1,0,0,1|2,0,0]=4 3165 B14R1.950 CCCC(C)Nc1cc(ccc1C)C 2230a_100000185781_100000766640 [0,0,1,0,0,1|2,0,0]=4 3166 B14R1.950 CCCC(C)Nc1cc(ccc1C)C 34a_100000185781_100000766640 [0,0,1,0,0,1|2,0,0]=4 3167 B14R1.950 CCCC(C)Nc1cc(ccc1C)C 7a_100000185781_100000766640 [0,0,1,0,0,1|2,0,0]=4 3168 B14R1.950 CCCC(C)Nc1cc(ccc1Cl)C 34a_100011215360_100000766640 [0,0,1,0,0,1|2,0,0]=4 3169 B14R1.950 CCCC(C)Nc1cc(ccc1F)C 34a_100000211285_100000766640 [0,0,1,0,0,1|2,0,0]=4 3170 B14R1.950 CCCC(C)Nc1cc(ccc1I)C 34a_100011216686_100000766640 [0,0,1,0,0,1|2,0,0]=4 3171 B14R1.950 CCCC(C)Nc1cc(ccc1O)C 34a_100011215204_100000766640 [0,0,1,0,0,1|2,0,0]=4 3172 B14R1.950 CCCC(C)Oc1cc(ccc1Br)C 34a_100012002257_100000766640 [0,0,1,0,0,1|2,0,0]=4 3173 B14R1.950 CCCC(C)Oc1cc(ccc1Br)C 7a_100012002257_100000766640 [0,0,1,0,0,1|2,0,0]=4 3174 B14R1.950 CCCC(C)Oc1cc(ccc1C)C 34a_100000210931_100000766640 [0,0,1,0,0,1|2,0,0]=4 3175 B14R1.950 CCCC(C)Oc1cc(ccc1C)C 7a_100000210931_100000766640 [0,0,1,0,0,1|2,0,0]=4 3176 B14R1.950 CCCC(C)Oc1cc(ccc1Cl)C 34a_100000211493_100000766640 [0,0,1,0,0,1|2,0,0]=4 3177 B14R1.950 CCCC(C)Oc1cc(ccc1Cl)C 7a_100000211493_100000766640 [0,0,1,0,0,1|2,0,0]=4 3178 B14R1.950 CCCC(C)Oc1cc(ccc1F)C 34a_100000759540_100000766640 [0,0,1,0,0,1|2,0,0]=4 3179 B14R1.950 CCCC(C)Oc1cc(ccc1F)C 7a_100000759540_100000766640 [0,0,1,0,0,1|2,0,0]=4 3180 B14R1.950 CCCC(C)Oc1cc(ccc1N)Br 34a_100000739049_100000766640 [0,0,1,0,0,1|2,0,0]=4 3181 B14R1.950 CCCC(C)Oc1cc(ccc1N)Br 7a_100000739049_100000766640 [0,0,1,0,0,1|2,0,0]=4 3182 B14R1.950 CCCC(C)Oc1cc(ccc1N)C 34a_100000211527_100000766640 [0,0,1,0,0,1|1,0,0]=3 3183 B14R1.950 CCCC(C)Oc1cc(ccc1N)C 7a_100000211527_100000766640 [0,0,1,0,0,1|1,0,0]=3 3184 B14R1.950 CCCC(C)Oc1cc(ccc1N)Cl 34a_100000185728_100000766640 [0,0,1,0,0,1|2,0,0]=4 3185 B14R1.950 CCCC(C)Oc1cc(ccc1N)Cl 7a_100000185728_100000766640 [0,0,1,0,0,1|2,0,0]=4 3186 B14R1.950 CCCC(C)Oc1cc(ccc1N)F 34a_100000753323_100000766640 [0,0,1,0,0,1|2,0,0]=4 3187 B14R1.950 CCCC(C)Oc1cc(ccc1N)F 7a_100000753323_100000766640 [0,0,1,0,0,1|2,0,0]=4 3188 B14R1.950 CCCC(C)Oc1cc(ccc1N)I 34a_100000057187_100000766640 [0,0,1,0,0,1|2,0,0]=4 3189 B14R1.950 CCCC(C)Oc1cc(ccc1N)I 7a_100000057187_100000766640 [0,0,1,0,0,1|2,0,0]=4 3190 B14R1.950 CCCC(C)Oc1cc(ccc1N)N 34a_100025717382_100000766640 [0,0,1,0,0,1|2,0,0]=4 3191 B14R1.950 CCCC(C)Oc1nc(ccc1N)C 34a_100000687486_100000766640 [0,0,1,0,0,1|2,0,0]=4 3192 B14R1.950 CCCC(C)Sc1cc(ccc1Br)C 62a_100000766640_100012353751 [0,0,1,0,0,1|2,0,0]=4 3193 B14R1.950 CCCC(C)Sc1cc(ccc1Br)C 62a_100012353751_100000766640 [0,0,1,0,0,1|2,0,0]=4 3194 B14R1.950 CCCC(C)Sc1cc(ccc1C)C 62a_100000210833_100000766640 [0,0,1,0,0,1|2,0,0]=4 3195 B14R1.950 CCCC(C)Sc1cc(ccc1C)C 62a_100000766640_100000210833 [0,0,1,0,0,1|2,0,0]=4 3196 B14R1.950 CCCC(C)Sc1cc(ccc1Cl)C 62a_100000766640_100012356289 [0,0,1,0,0,1|2,0,0]=4 3197 B14R1.950 CCCC(C)Sc1cc(ccc1Cl)C 62a_100012356289_100000766640 [0,0,1,0,0,1|2,0,0]=4 3198 B14R1.950 CCCC(C)Sc1cc(ccc1F)C 62a_100000736223_100000766640 [0,0,1,0,0,1|2,0,0]=4 3199 B14R1.950 CCCC(C)Sc1cc(ccc1F)C 62a_100000766640_100000736223 [0,0,1,0,0,1|2,0,0]=4 3200 B14R1.950 CCCC(C)Sc1cc(ccc1N)Br 62a_100000187925_100000766640 [0,0,1,0,0,1|2,0,0]=4 3201 B14R1.950 CCCC(C)Sc1cc(ccc1N)Br 62a_100000766640_100000187925 [0,0,1,0,0,1|2,0,0]=4 3202 B14R1.950 CCCC(C)Sc1cc(ccc1N)C 62a_100000766640_100011356834 [0,0,1,0,0,1|1,0,0]=3 3203 B14R1.950 CCCC(C)Sc1cc(ccc1N)C 62a_100011356834_100000766640 [0,0,1,0,0,1|1,0,0]=3 3204 B14R1.950 CCCC(C)Sc1cc(ccc1N)Cl 62a_100000761889_100000766640 [0,0,1,0,0,1|2,0,0]=4 3205 B14R1.950 CCCC(C)Sc1cc(ccc1N)Cl 62a_100000766640_100000761889 [0,0,1,0,0,1|2,0,0]=4 3206 B14R1.950 CCCC(C)Sc1cc(ccc1N)F 62a_100000760547_100000766640 [0,0,1,0,0,1|2,0,0]=4 3207 B14R1.950 CCCC(C)Sc1cc(ccc1N)F 62a_100000766640_100000760547 [0,0,1,0,0,1|2,0,0]=4 3208 B14R1.950 CCCC(C)Sc1cc(ccc1N)N 62a_100000766640_100011534242 [0,0,1,0,0,1|2,0,0]=4 3209 B14R1.950 CCCC(C)Sc1cc(ccc1N)N 62a_100011534242_100000766640 [0,0,1,0,0,1|2,0,0]=4 3210 B14R1.950 CCCC(C)Sc1cc(ccc1N)O 62a_100000766640_100012001276 [0,0,1,0,0,1|2,0,0]=4 3211 B14R1.950 CCCC(C)Sc1cc(ccc1N)O 62a_100012001276_100000766640 [0,0,1,0,0,1|2,0,0]=4 3212 B14R1.950 CCCC(C)Sc1cc(ccc1O)C 62a_100000765521_100000766640 [0,0,1,0,0,1|2,0,0]=4 3213 B14R1.950 CCCC(C)Sc1cc(ccc1O)C 62a_100000766640_100000765521 [0,0,1,0,0,1|2,0,0]=4 3214 B14R1.950 CCCC(C)Sc1cc(cnc1N)C 62a_100000049664_100000766640 [0,0,1,0,0,1|2,0,0]=4 3215 B14R1.950 CCCC(C)Sc1cc(cnc1N)C 62a_100000766640_100000049664 [0,0,1,0,0,1|2,0,0]=4 3216 B14R1.950 CCCC(C)Sc1nc(ccc1N)C 62a_100000685570_100000766640 [0,0,1,0,0,1|2,0,0]=4 3217 B14R1.950 CCCC(C)Sc1nc(ccc1N)C 62a_100000766640_100000685570 [0,0,1,0,0,1|2,0,0]=4 3218 B14R1.950 COCC(C)Oc1cc(ccc1N)C 34a_100000211527_100000765312 [0,0,1,0,0,1|2,0,0]=4 3219 B14R1.950 COCC(C)Oc1cc(ccc1N)C 7a_100000211527_100000765312 [0,0,1,0,0,1|2,0,0]=4 3220 B14R1.950 COCC(C)Sc1cc(ccc1N)C 62a_100000765312_100011356834 [0,0,1,0,0,1|2,0,0]=4 3221 B14R1.950 COCC(C)Sc1cc(ccc1N)C 62a_100011356834_100000765312 [0,0,1,0,0,1|2,0,0]=4 3222 B14R1.950 Cc1ccc(c(c1)OC(C)CCO)N 34a_100000211527_100009893172 [0,0,1,0,0,1|2,0,0]=4 3223 B14R1.950 Cc1ccc(c(c1)OC(C)CCO)N 7a_100000211527_100009893172 [0,0,1,0,0,1|2,0,0]=4 3224 B14R1.950 Cc1ccc(c(c1)SC(C)CCO)N 62a_100009893172_100011356834 [0,0,1,0,0,1|2,0,0]=4 3225 B14R1.950 Cc1ccc(c(c1)SC(C)CCO)N 62a_100011356834_100009893172 [0,0,1,0,0,1|2,0,0]=4