0 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.7724 Cn1cc(c2ccccc2c1=O)O 271570a_203496583355_100000239302 [0,0,0,0,0,0|4,0,0]=4 2 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [1,0,0,0,0,0|1,0,1]=3 3 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [1,0,0,0,0,0|2,0,1]=4 4 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [1,0,0,0,0,0|1,0,1]=3 14 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [1,0,0,0,0,0|2,0,1]=4 15 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [1,0,0,0,0,0|1,0,2]=4 17 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [1,0,0,0,0,0|2,0,0]=3 20 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [1,0,0,0,0,0|1,0,2]=4 22 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [1,0,0,0,0,0|0,0,2]=3 24 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [1,0,0,0,0,0|0,0,0]=1 25 B13R2.328 O=c1cc(c2cccnc2[nH]1)O 271570a_203496583355_100010499609 [1,0,0,0,0,0|1,0,0]=2 26 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [1,0,0,0,0,0|1,0,1]=3 27 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [1,0,0,0,0,0|1,0,1]=3 28 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [1,0,0,0,0,0|3,0,0]=4 31 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [1,0,0,0,0,0|3,0,0]=4 32 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [1,0,0,0,0,0|2,0,1]=4 33 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [1,0,0,0,0,0|1,0,0]=2 34 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [1,0,0,0,0,0|2,0,0]=3 35 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.371 Cc1nnc(c2c1cccc2)O 271570a_203496583355_100000189618 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [1,0,0,0,0,0|2,0,0]=3 39 B13R2.371 Nc1ccc(c2c1cccn2)O 271570a_203496583355_100012360041 [1,0,0,0,0,0|3,0,0]=4 40 B13R2.371 Nc1ccc(c2c1ccnc2)O 271570a_203496583355_200012344021 [1,0,0,0,0,0|3,0,0]=4 41 B13R2.371 Nc1ccc(c2c1cncc2)O 271570a_203496583355_100011218454 [1,0,0,0,0,0|3,0,0]=4 42 B13R2.371 Nc1ccc(c2c1nccc2)O 271570a_203496583355_100000726955 [1,0,0,0,0,0|3,0,0]=4 43 B13R2.371 Nc1cnc(c2c1cccc2)O 271570a_203496583355_200009868590 [1,0,0,0,0,0|3,0,0]=4 44 B13R2.371 Nc1ncc(c2c1cccc2)O 271570a_203496583355_100010158575 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [1,0,0,0,0,0|2,0,0]=3 46 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [1,0,0,0,0,0|2,0,0]=3 47 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [1,0,0,0,0,0|2,0,0]=3 48 B13R2.371 Oc1ccc(c2c1cccn2)F 271570a_203496583355_100010245834 [1,0,0,0,0,0|3,0,0]=4 49 B13R2.371 Oc1ccc(c2c1cccn2)O 271570a_203496583355_100011934063 [1,0,0,0,0,0|3,0,0]=4 50 B13R2.371 Oc1ccc(c2c1ccnc2)F 271570a_203496583355_100000698020 [1,0,0,0,0,0|3,0,0]=4 51 B13R2.371 Oc1ccc(c2c1cncc2)F 271570a_203496583355_100010244717 [1,0,0,0,0,0|3,0,0]=4 52 B13R2.371 Oc1ccc(c2c1nccc2)F 271570a_203496583355_100010214461 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100000067196 [1,0,0,0,0,0|3,0,0]=4 54 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100009816523 [1,0,0,0,0,0|3,0,0]=4 55 B13R2.371 [O-][n+]1ccc(c2c1cccc2)O 271570a_203496583355_100020656173 [1,0,0,0,0,0|1,0,1]=3 56 B15R2.6124 CNc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200000210301 [0,1,0,0,0,0|3,0,0]=4 57 B15R2.6124 CNc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200000210301 [0,1,0,0,0,0|3,0,0]=4 58 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200000210301 [0,1,0,0,0,0|3,0,0]=4 59 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200000210301 [0,1,0,0,0,0|3,0,0]=4 60 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200025704644 [0,1,0,0,0,0|3,0,0]=4 61 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200025704644 [0,1,0,0,0,0|3,0,0]=4 62 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200025704644 [0,1,0,0,0,0|3,0,0]=4 63 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200025704644 [0,1,0,0,0,0|3,0,0]=4 64 B15R2.9032 Cc1c(c(=O)n(c2c1cccc2)C)O 271570a_203496583355_100010739255 [0,1,0,0,0,0|1,0,0]=2 65 B15R2.19973 O=Cc1cc(c2ccccc2c1F)O 271570a_203496583355_100010235050 [0,1,0,0,0,0|2,0,0]=3 66 B15R2.21211 C=Cc1cc(=O)n(c2c1cccc2)C 271570a_100011290941_100000041018 [0,1,0,0,0,0|1,0,0]=2 67 B15R2.21211 CNc1cc(=O)n(c2c1cccc2)C 27a_100102657272_100000041018 [0,1,0,0,0,0|1,0,0]=2 68 B15R2.21211 CSc1cc(=O)n(c2c1cccc2)C 62a_100010246319_200000210301 [0,1,0,0,0,0|0,1,0]=2 69 B15R2.21211 CSc1cc(=O)n(c2c1cccc2)C 62a_200000210301_100000041018 [0,1,0,0,0,0|0,1,0]=2 70 B15R2.21211 Cn1c(=O)cc(c2c1cccc2)S[13CH3] 62a_100010246319_200025704644 [0,1,0,0,0,0|0,1,0]=2 71 B15R2.21211 Cn1c(=O)cc(c2c1cccc2)S[13CH3] 62a_200025704644_100000041018 [0,1,0,0,0,0|0,1,0]=2 72 B15R2.63814 Cn1c(=O)oc(=O)c2c1ccc(c2)O 271570a_203496583355_100009812665 [0,1,0,0,0,0|1,0,1]=3 73 B13R1.11 CC(=CC(=O)CF)c1ccccc1 1458a_100000743005_100015361967 [0,0,1,0,0,0|3,0,0]=4 74 B13R1.11 CCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000210202 [0,0,1,0,0,0|2,0,0]=3 75 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747405 [0,0,1,0,0,0|1,0,2]=4 76 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000210414_100000211460 [0,0,1,0,0,0|1,0,2]=4 77 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000210414_100000185958 [0,0,1,0,0,0|1,0,2]=4 78 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000210202 [0,0,1,0,0,0|1,0,2]=4 79 B13R1.11 CCC(=O)C[C@@H](O)c1ccccc1 1458a_100000210414_100011933945 [0,0,1,0,0,0|1,0,2]=4 80 B13R1.11 CNC(=O)C=C(C)c1ccccc1 11a_106832991635_100000743005 [0,0,1,0,0,0|1,0,0]=2 81 B13R1.11 CNC(=O)C=C(C)c1ccccc1 1626a_100102657272_100000743005 [0,0,1,0,0,0|1,0,0]=2 82 B13R1.11 CNC(=O)C=C(C)c1ccccc1 240690a_100102657272_100000743005 [0,0,1,0,0,0|1,0,0]=2 83 B13R1.11 CNC(=O)C=C(C)c1ccccc1 527a_100102657272_100000743005 [0,0,1,0,0,0|1,0,0]=2 84 B13R1.11 CNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183359 [0,0,1,0,0,0|0,0,2]=3 85 B13R1.11 CNC(=O)CC(C)c1ccccc1 11a_106832991635_100000183687 [0,0,1,0,0,0|1,0,2]=4 86 B13R1.11 CNC(=O)CC(C)c1ccccc1 1626a_100102657272_100000183687 [0,0,1,0,0,0|1,0,2]=4 87 B13R1.11 CNC(=O)CC(C)c1ccccc1 240690a_100102657272_100000183687 [0,0,1,0,0,0|1,0,2]=4 88 B13R1.11 CNC(=O)CC(C)c1ccccc1 527a_100102657272_100000183687 [0,0,1,0,0,0|1,0,2]=4 89 B13R1.11 CNC(=O)CC(O)c1ccccc1 240690a_100102657272_100000690199 [0,0,1,0,0,0|0,0,2]=3 90 B13R1.11 CNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000183359 [0,0,1,0,0,0|2,0,1]=4 91 B13R1.11 CNC(=O)CN(C)c1ccccc1 240690a_100102657272_100000745425 [0,0,1,0,0,0|2,0,1]=4 92 B13R1.11 CNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000183359 [0,0,1,0,0,0|2,0,1]=4 93 B13R1.11 CNC(=O)CN(C)c1ccccc1 34a_100000210012_100000183359 [0,0,1,0,0,0|2,0,1]=4 94 B13R1.11 CNC(=O)CN(C)c1ccccc1 527a_100102657272_100000745425 [0,0,1,0,0,0|2,0,1]=4 95 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_106832991635 [0,0,1,0,0,0|2,0,1]=4 96 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100102657272_100000751104 [0,0,1,0,0,0|2,0,1]=4 97 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100102657272 [0,0,1,0,0,0|2,0,1]=4 98 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100102657272_100000751104 [0,0,1,0,0,0|2,0,1]=4 99 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100102657272 [0,0,1,0,0,0|2,0,1]=4 100 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_106832991638_100000751104 [0,0,1,0,0,0|2,0,1]=4 101 B13R1.11 COC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747449 [0,0,1,0,0,0|1,0,2]=4 102 B13R1.47 C#CCC(=O)N(C)c1ccccc1 1626a_100000210012_100011220946 [0,0,1,0,0,0|1,0,2]=4 103 B13R1.47 C=CCC(=O)C(C)c1ccccc1 1458a_100000210193_100000230085 [0,0,1,0,0,0|2,0,1]=4 104 B13R1.47 C=CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210193 [0,0,1,0,0,0|1,0,1]=3 105 B13R1.47 C=CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210193 [0,0,1,0,0,0|1,0,1]=3 106 B13R1.47 C=CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210193 [0,0,1,0,0,0|1,0,1]=3 107 B13R1.47 C=CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210623 [0,0,1,0,0,0|2,0,1]=4 108 B13R1.47 CC#CC(=O)N(C)c1ccccc1 22a_100000210012_100000763181 [0,0,1,0,0,0|1,0,2]=4 109 B13R1.47 CC(C(=O)C=CBr)c1ccccc1 1458a_100016273825_100000230085 [0,0,1,0,0,0|2,0,0]=3 110 B13R1.47 CC(C(=O)C=CCl)c1ccccc1 1458a_200016279998_100000230085 [0,0,1,0,0,0|2,0,0]=3 111 B13R1.47 CC(C(=O)C=CI)c1ccccc1 1458a_100016256311_100000230085 [0,0,1,0,0,0|2,0,0]=3 112 B13R1.47 CC(C(=O)CCO)c1ccccc1 1458a_100011216618_100000230085 [0,0,1,0,0,0|1,0,2]=4 113 B13R1.47 CC=CC(=O)C(C)c1ccccc1 1458a_100000210699_100000230085 [0,0,1,0,0,0|2,0,0]=3 114 B13R1.47 CC=CC(=O)N(C)c1ccccc1 11a_100000210012_100000210699 [0,0,1,0,0,0|1,0,0]=2 115 B13R1.47 CC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000210699 [0,0,1,0,0,0|1,0,0]=2 116 B13R1.47 CC=CC(=O)N(C)c1ccccc1 22a_100000210012_100000210699 [0,0,1,0,0,0|1,0,0]=2 117 B13R1.47 CCCC(=O)N(C)c1ccccc1 11a_100000210012_100000211992 [0,0,1,0,0,0|1,0,2]=4 118 B13R1.47 CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000211992 [0,0,1,0,0,0|1,0,2]=4 119 B13R1.47 CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000211992 [0,0,1,0,0,0|1,0,2]=4 120 B13R1.47 CCNC(=O)N(C)c1ccccc1 512a_100015525214_100000210012 [0,0,1,0,0,0|2,0,1]=4 121 B13R1.47 CN(C(=O)C=CBr)c1ccccc1 1626a_100000210012_100016273825 [0,0,1,0,0,0|1,0,0]=2 122 B13R1.47 CN(C(=O)C=CCl)c1ccccc1 11a_100000210012_200016279998 [0,0,1,0,0,0|1,0,0]=2 123 B13R1.47 CN(C(=O)C=CCl)c1ccccc1 1626a_100000210012_200016279998 [0,0,1,0,0,0|1,0,0]=2 124 B13R1.47 CN(C(=O)C=CI)c1ccccc1 1626a_100000210012_100016256311 [0,0,1,0,0,0|1,0,0]=2 125 B13R1.47 CN(C(=O)CC#N)c1ccccc1 1626a_100000210012_100051588842 [0,0,1,0,0,0|1,0,2]=4 126 B13R1.47 CN(C(=O)CC#N)c1ccccc1 22a_100000210012_100051588842 [0,0,1,0,0,0|1,0,2]=4 127 B13R1.47 CN(C(=O)CCO)c1ccccc1 22a_100000210012_100011216618 [0,0,1,0,0,0|0,0,2]=3 128 B13R1.47 CN(C(=O)CN[13CH3])c1ccccc1 2230a_200000174886_200025704644 [0,0,1,0,0,0|2,0,1]=4 129 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_100000183487_200025704644 [0,0,1,0,0,0|2,0,1]=4 130 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_200025704644_100000183487 [0,0,1,0,0,0|2,0,1]=4 131 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_106832991635_100000183487 [0,0,1,0,0,0|2,0,1]=4 132 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_200000174886_200000210301 [0,0,1,0,0,0|2,0,1]=4 133 B13R1.47 CNCC(=O)N(C)c1ccccc1 34a_100102657272_100000183487 [0,0,1,0,0,0|2,0,1]=4 134 B13R1.47 CNCC(=O)N(C)c1ccccc1 7a_106832991635_100000183487 [0,0,1,0,0,0|2,0,1]=4 135 B13R1.47 CNNC(=O)N(C)c1ccccc1 512a_100016993582_100000210012 [0,0,1,0,0,0|3,0,0]=4 136 B13R1.47 COCC(=O)N(C)c1ccccc1 11a_100000210012_100000210968 [0,0,1,0,0,0|2,0,1]=4 137 B13R1.47 COCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210968 [0,0,1,0,0,0|2,0,1]=4 138 B13R1.47 COCC(=O)N(C)c1ccccc1 22a_100000210012_100000210968 [0,0,1,0,0,0|2,0,1]=4 139 B13R1.47 COCC(=O)N(C)c1ccccc1 34a_100138415774_100000183487 [0,0,1,0,0,0|2,0,1]=4 140 B13R1.47 CSCC(=O)N(C)c1ccccc1 11a_100000210012_100000184570 [0,0,1,0,0,0|2,0,1]=4 141 B13R1.47 CSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000184570 [0,0,1,0,0,0|2,0,1]=4 142 B13R1.47 CSCC(=O)N(C)c1ccccc1 22a_100000210012_100000184570 [0,0,1,0,0,0|2,0,1]=4 143 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_100000183487_200000210301 [0,0,1,0,0,0|2,0,1]=4 144 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_200000210301_100000183487 [0,0,1,0,0,0|2,0,1]=4 145 B13R1.47 C[C@H](C(=O)CCO)c1ccccc1 1458a_100000751047_100000211926 [0,0,1,0,0,0|1,0,2]=4 146 B13R1.89 CC(=O)N(C)c1ccccc1C#N 11a_100000744078_100015343762 [0,0,1,0,0,0|1,0,2]=4 147 B13R1.89 CC(=O)N(C)c1ccccc1C#N 1626a_100000744078_100015343762 [0,0,1,0,0,0|1,0,2]=4 148 B13R1.89 COc1ccccc1N(C)C(=O)C 11a_100000219746_100015343762 [0,0,1,0,0,0|2,0,1]=4 149 B13R1.89 COc1ccccc1N(C)C(=O)C 1626a_100000219746_100015343762 [0,0,1,0,0,0|2,0,1]=4 150 B13R1.89 COc1ccccc1N(C)C(=O)C 22a_100000219746_100000070787 [0,0,1,0,0,0|2,0,1]=4 151 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [1,0,1,0,0,0|1,0,0]=3 152 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [1,0,1,0,0,0|2,0,0]=4 153 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [1,0,1,0,0,0|2,0,0]=4 154 B12R1.27 CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210202 [1,0,1,0,0,0|2,0,0]=4 155 B12R1.27 CNC(=O)C#Cc1ccccc1 240690a_100102657272_100000736102 [1,0,1,0,0,0|0,0,2]=4 156 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [1,0,1,0,0,0|0,0,0]=2 157 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [1,0,1,0,0,0|0,0,0]=2 158 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [1,0,1,0,0,0|1,0,0]=3 159 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [1,0,1,0,0,0|1,0,0]=3 160 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [1,0,1,0,0,0|1,0,0]=3 161 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [1,0,1,0,0,0|1,0,0]=3 162 B12R1.27 CNC(=O)C=Cc1ccncc1 240690a_100102657272_100000682801 [1,0,1,0,0,0|1,0,0]=3 163 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [1,0,1,0,0,0|0,0,2]=4 164 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [1,0,1,0,0,0|0,0,2]=4 165 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [1,0,1,0,0,0|0,0,2]=4 166 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [1,0,1,0,0,0|0,0,2]=4 167 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [1,0,1,0,0,0|1,0,1]=4 168 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [1,0,1,0,0,0|1,0,1]=4 169 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [1,0,1,0,0,0|1,0,1]=4 170 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [1,0,1,0,0,0|1,0,1]=4 171 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [1,0,1,0,0,0|1,0,1]=4 172 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [1,0,1,0,0,0|1,0,1]=4 173 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [1,0,1,0,0,0|1,0,1]=4 174 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [1,0,1,0,0,0|1,0,1]=4 175 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [1,0,1,0,0,0|1,0,1]=4 176 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [1,0,1,0,0,0|1,0,1]=4 177 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [1,0,1,0,0,0|1,0,1]=4 178 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [1,0,1,0,0,0|1,0,1]=4 179 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [1,0,1,0,0,0|1,0,1]=4 180 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100015324214_106832991635 [1,0,1,0,0,0|1,0,1]=4 181 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100102657272_100015324214 [1,0,1,0,0,0|1,0,1]=4 182 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100015324214_100102657272 [1,0,1,0,0,0|1,0,1]=4 183 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100102657272_100015324214 [1,0,1,0,0,0|1,0,1]=4 184 B12R1.27 CNC(=O)NCc1ccccc1 512a_100015324214_100102657272 [1,0,1,0,0,0|1,0,1]=4 185 B12R1.27 CNC(=O)NCc1ccccc1 512a_106832991638_100015324214 [1,0,1,0,0,0|1,0,1]=4 186 B12R1.27 CNC(=O)NNc1ccccc1 273464a_100102657272_100015195140 [1,0,1,0,0,0|2,0,0]=4 187 B12R1.27 CNC(=O)NNc1ccccc1 512a_106832991638_100015195140 [1,0,1,0,0,0|2,0,0]=4 188 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [1,0,1,0,0,0|2,0,0]=4 189 B12R1.30 C/C=C/CN(C)c1ccccc1 269982a_100000210012_100102629194 [1,0,1,0,0,0|1,0,1]=4 190 B12R1.30 C/C=C/CN(C)c1ccccc1 34a_100000210012_100102629194 [1,0,1,0,0,0|1,0,1]=4 191 B12R1.30 CC=CCN(C)c1ccccc1 2230a_100000210012_100000070051 [1,0,1,0,0,0|1,0,1]=4 192 B12R1.30 CC=CCN(C)c1ccccc1 34a_100000210012_100000070051 [1,0,1,0,0,0|1,0,1]=4 193 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [1,0,1,0,0,0|1,0,0]=3 194 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [1,0,1,0,0,0|1,0,0]=3 195 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,0,1,0,0,0|0,0,2]=4 196 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,0,1,0,0,0|0,0,2]=4 197 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,0,1,0,0,0|0,0,2]=4 198 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,0,1,0,0,0|0,0,2]=4 199 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [1,0,1,0,0,0|0,0,2]=4 200 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,0,1,0,0,0|0,0,2]=4 201 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [1,0,1,0,0,0|1,0,1]=4 202 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [1,0,1,0,0,0|1,0,1]=4 203 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [1,0,1,0,0,0|1,0,1]=4 204 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [1,0,1,0,0,0|1,0,1]=4 205 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [1,0,1,0,0,0|2,0,0]=4 206 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [1,0,1,0,0,0|1,0,0]=3 207 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [1,0,1,0,0,0|1,0,0]=3 208 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [1,0,1,0,0,0|1,0,0]=3 209 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [1,0,1,0,0,0|2,0,0]=4 210 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [1,0,1,0,0,0|1,0,0]=3 211 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [1,0,1,0,0,0|2,0,0]=4 212 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [1,0,1,0,0,0|1,0,0]=3 213 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [1,0,1,0,0,0|1,0,0]=3 214 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [1,0,1,0,0,0|2,0,0]=4 215 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [1,0,1,0,0,0|1,0,0]=3 216 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [1,0,1,0,0,0|0,0,2]=4 217 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [1,0,1,0,0,0|1,0,0]=3 218 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [1,0,1,0,0,0|0,0,0]=2 219 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [1,0,1,0,0,0|0,0,0]=2 220 B12R1.34 C=CC(C)N(C)c1ccccc1 269982a_100000210012_100011215867 [1,0,1,0,0,0|1,0,1]=4 221 B12R1.34 CC(C(=O)CO)c1ccccc1 1458a_100000210174_100000230085 [1,0,1,0,0,0|1,0,1]=4 222 B12R1.34 CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210414 [1,0,1,0,0,0|0,0,2]=4 223 B12R1.34 CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210414 [1,0,1,0,0,0|0,0,2]=4 224 B12R1.34 CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210414 [1,0,1,0,0,0|0,0,2]=4 225 B12R1.34 CN(C(=O)CO)c1ccccc1 22a_100000210012_100000210174 [1,0,1,0,0,0|0,0,1]=3 226 B12R1.34 CNC(=O)N(C)c1ccccc1 512a_106832991638_100000210012 [1,0,1,0,0,0|1,0,1]=4 227 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [1,0,1,0,0,0|1,0,1]=4 228 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [1,0,1,0,0,0|1,0,1]=4 229 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [1,0,1,0,0,0|1,0,1]=4 230 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [1,0,1,0,0,0|1,0,1]=4 231 B12R1.75 C=Cc1ccccc1NC(=O)N 271570a_100011290941_100000742221 [1,0,1,0,0,0|2,0,0]=4 232 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [1,0,1,0,0,0|0,0,2]=4 233 B12R1.124 CC(=O)N(C)c1ccccc1Br 11a_100020606079_100015343762 [1,0,1,0,0,0|1,0,1]=4 234 B12R1.124 CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100015343762 [1,0,1,0,0,0|1,0,1]=4 235 B12R1.124 CC(=O)N(C)c1ccccc1C 11a_100000219699_100015343762 [1,0,1,0,0,0|0,0,2]=4 236 B12R1.124 CC(=O)N(C)c1ccccc1C 1626a_100000219699_100015343762 [1,0,1,0,0,0|0,0,2]=4 237 B12R1.124 CC(=O)N(C)c1ccccc1C 22a_100000219699_100000070787 [1,0,1,0,0,0|0,0,2]=4 238 B12R1.124 CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100015343762 [1,0,1,0,0,0|1,0,1]=4 239 B12R1.124 CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100015343762 [1,0,1,0,0,0|1,0,1]=4 240 B12R1.124 CC(=O)N(C)c1ccccc1F 11a_100000220357_100015343762 [1,0,1,0,0,0|1,0,1]=4 241 B12R1.124 CC(=O)N(C)c1ccccc1F 1626a_100000220357_100015343762 [1,0,1,0,0,0|1,0,1]=4 242 B12R1.124 CC(=O)N(C)c1ccccc1F 22a_100000220357_100000070787 [1,0,1,0,0,0|1,0,1]=4 243 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [1,0,1,0,0,0|0,0,1]=3 244 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [1,0,1,0,0,0|0,0,1]=3 245 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000210623_100000726605 [1,0,1,0,0,0|1,0,1]=4 246 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000726605_100000210623 [1,0,1,0,0,0|1,0,1]=4 247 B12R1.121 CNc1ccccc1OCC=O 34a_100000033821_200009817547 [1,0,1,0,0,0|1,0,1]=4 248 B12R1.121 CNc1ccccc1SCC=O 62a_100020606079_200015260668 [1,0,1,0,0,0|1,0,1]=4 249 B12R1.121 CNc1ccccc1SCC=O 62a_200015260668_100020606079 [1,0,1,0,0,0|1,0,1]=4 250 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200000210301_200016268969 [1,0,1,0,0,0|1,0,0]=3 251 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200016268969_200000210301 [1,0,1,0,0,0|1,0,0]=3 252 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200016268969_200025704644 [1,0,1,0,0,0|1,0,0]=3 253 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200025704644_200016268969 [1,0,1,0,0,0|1,0,0]=3 254 B12R1.261 C=C(C)c1ccccc1C(=O)C 271570a_100000694244_100000751169 [1,0,1,0,0,0|2,0,0]=4 255 B12R1.261 C=C(C)c1ccccc1N(C)C 271570a_100000694244_100011290883 [1,0,1,0,0,0|1,0,1]=4 256 B12R1.261 C=C(C)c1ccccc1S(=O)C 271570a_100000694244_100000734199 [1,0,1,0,0,0|2,0,0]=4 257 B12R1.385 C=CCSc1ccc(=O)n(c1)C 62a_100000210623_100011245003 [1,0,1,0,0,0|1,0,1]=4 258 B12R1.385 C=CCSc1ccc(=O)n(c1)C 62a_100011245003_100000210623 [1,0,1,0,0,0|1,0,1]=4 259 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [2,0,0,0,0,0|1,0,1]=4 260 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [2,0,0,0,0,0|0,0,2]=4 261 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [2,0,0,0,0,0|1,0,0]=3 262 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [2,0,0,0,0,0|2,0,0]=4 263 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [2,0,0,0,0,0|2,0,0]=4 264 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [2,0,0,0,0,0|2,0,0]=4 265 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [2,0,0,0,0,0|2,0,0]=4 266 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [2,0,0,0,0,0|0,0,1]=3 267 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [2,0,0,0,0,0|1,0,1]=4 268 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [2,0,0,0,0,0|1,0,1]=4 269 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [2,0,0,0,0,0|2,0,0]=4 270 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [2,0,0,0,0,0|1,0,1]=4 271 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [2,0,0,0,0,0|2,0,0]=4 272 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [2,0,0,0,0,0|1,0,1]=4 273 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000183359 [0,1,1,0,0,0|0,0,2]=4 274 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000183359 [0,1,1,0,0,0|0,0,2]=4 275 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000183359 [0,1,1,0,0,0|0,0,2]=4 276 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000183359 [0,1,1,0,0,0|0,0,2]=4 277 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000183359 [0,1,1,0,0,0|0,0,2]=4 278 B14R1.10 CNC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000183359 [0,1,1,0,0,0|0,0,2]=4 279 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000183359 [0,1,1,0,0,0|0,0,2]=4 280 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)C 1458a_100000189346_100000183359 [0,1,1,0,0,0|0,0,2]=4 281 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000183359 [0,1,1,0,0,0|0,0,2]=4 282 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)F 1458a_100000210950_100000183359 [0,1,1,0,0,0|0,0,2]=4 283 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)I 1458a_100000184098_100000183359 [0,1,1,0,0,0|0,0,2]=4 284 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000183359 [0,1,1,0,0,0|0,0,2]=4 285 B14R1.11 CNC(=O)C[C@H](O)c1cccc(c1)Cl 240690a_100102657272_100010423400 [0,1,1,0,0,0|0,0,2]=4 286 B14R1.29 CC(=CC(=O)CCF)c1ccccc1 1458a_100000743005_100011217306 [0,1,1,0,0,0|2,0,0]=4 287 B14R1.29 CC(=CC(=O)CCO)c1ccccc1 1458a_100000743005_100000211926 [0,1,1,0,0,0|2,0,0]=4 288 B14R1.29 CCCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000210303 [0,1,1,0,0,0|2,0,0]=4 289 B14R1.29 CCNC(=O)C=C(C)c1ccccc1 11a_100015525214_100000743005 [0,1,1,0,0,0|1,0,0]=3 290 B14R1.29 CCNC(=O)C=C(C)c1ccccc1 240690a_100015525214_100000743005 [0,1,1,0,0,0|1,0,0]=3 291 B14R1.29 CCNC(=O)C=C(C)c1ccccc1 527a_100015525214_100000743005 [0,1,1,0,0,0|1,0,0]=3 292 B14R1.29 CCNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183381 [0,1,1,0,0,0|0,0,2]=4 293 B14R1.29 CCNC(=O)CC(O)c1ccccc1 240690a_100015525214_100000690199 [0,1,1,0,0,0|0,0,2]=4 294 B14R1.29 CCOC(=O)/C=C(\C)/c1ccccc1 271570a_100050291487_100000210277 [0,1,1,0,0,0|2,0,0]=4 295 B14R1.29 CNCC(=O)NC(=O)c1ccccc1 7a_106832991635_100000010347 [0,1,1,0,0,0|1,0,1]=4 296 B14R1.29 CNNC(=O)C=C(C)c1ccccc1 22a_100016993582_100000743005 [0,1,1,0,0,0|1,0,0]=3 297 B14R1.29 CNNC(=O)CC(O)c1ccccc1 22a_100016993582_100000690199 [0,1,1,0,0,0|0,0,2]=4 298 B14R1.29 O=C(CC(=O)c1ccccc1)NCO 1458a_100000185807_100000185155 [0,1,1,0,0,0|0,0,2]=4 299 B14R1.85 CNC(=O)C(=O)C(C)c1ccccc1 1458a_100011218921_100000230085 [0,1,1,0,0,0|1,0,1]=4 300 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 1626a_100000210012_100011218921 [0,1,1,0,0,0|2,0,0]=4 301 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 1626a_100102657272_100011297159 [0,1,1,0,0,0|2,0,0]=4 302 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 22a_100000210012_100011218921 [0,1,1,0,0,0|2,0,0]=4 303 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 240690a_100102657272_100011297159 [0,1,1,0,0,0|2,0,0]=4 304 B14R1.85 CNC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000209862 [0,1,1,0,0,0|0,0,2]=4 305 B14R1.85 CNC(=O)C(F)C(=O)c1ccccc1 1458a_100000185807_100009813575 [0,1,1,0,0,0|0,0,2]=4 306 B14R1.415 CC(=CC(=O)C(C)C)c1ccccc1 1458a_100000743005_100000210206 [0,1,1,0,0,0|2,0,0]=4 307 B14R1.415 CC(=CC(=O)N(C)C)c1ccccc1 11a_100102631434_100000743005 [0,1,1,0,0,0|1,0,0]=3 308 B14R1.415 CC(=CC(=O)N(C)C)c1ccccc1 1626a_100102631434_100000743005 [0,1,1,0,0,0|1,0,0]=3 309 B14R1.415 CC(=CC(=O)N(C)C)c1ccccc1 240690a_100102631434_100000743005 [0,1,1,0,0,0|1,0,0]=3 310 B14R1.415 CC(=CC(=O)N(C)C)c1ccccc1 527a_100102631434_100000743005 [0,1,1,0,0,0|1,0,0]=3 311 B14R1.415 CN(C)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100000185267 [0,1,1,0,0,0|0,0,2]=4 312 B14R1.415 CN(C)C(=O)CC(O)c1ccccc1 240690a_100102631434_100000690199 [0,1,1,0,0,0|0,0,2]=4 313 B14R1.587 CNC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000183359 [0,1,1,0,0,0|0,0,2]=4 314 B14R1.587 CNC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000183359 [0,1,1,0,0,0|0,0,2]=4 315 B14R1.587 CNC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000183359 [0,1,1,0,0,0|0,0,2]=4 316 B14R1.587 CNC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000183359 [0,1,1,0,0,0|0,0,2]=4 317 B14R1.587 CNC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000183359 [0,1,1,0,0,0|0,0,2]=4 318 B14R1.587 CNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183359 [0,1,1,0,0,0|0,0,2]=4 319 B14R1.587 CNC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000183359 [0,1,1,0,0,0|0,0,2]=4 320 B14R1.3297 CNC(=O)CC(CO)c1ccccc1 1626a_100102657272_106726389045 [0,1,1,0,0,0|0,0,2]=4 321 B14R1.3297 CNC(=O)CC(CO)c1ccccc1 240690a_100102657272_106726389045 [0,1,1,0,0,0|0,0,2]=4 322 B14R1.3297 CNC(=O)N[C@H](CO)c1ccccc1 2708a_100102657272_100000751927 [0,1,1,0,0,0|1,0,1]=4 323 B14R1.3297 CNC(=O)N[C@H](CO)c1ccccc1 273464a_100000751927_100102657272 [0,1,1,0,0,0|1,0,1]=4 324 B14R1.3297 CNC(=O)N[C@H](CO)c1ccccc1 273464a_100102657272_100000751927 [0,1,1,0,0,0|1,0,1]=4 325 B14R1.3297 CNC(=O)N[C@H](CO)c1ccccc1 512a_106832991638_100000751927 [0,1,1,0,0,0|1,0,1]=4 326 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000210193 [0,1,1,0,0,0|1,0,1]=4 327 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000210193 [0,1,1,0,0,0|1,0,1]=4 328 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000210193 [0,1,1,0,0,0|1,0,1]=4 329 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000210193 [0,1,1,0,0,0|1,0,1]=4 330 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000210193 [0,1,1,0,0,0|1,0,1]=4 331 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000210193 [0,1,1,0,0,0|1,0,1]=4 332 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000210193 [0,1,1,0,0,0|1,0,1]=4 333 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000210193 [0,1,1,0,0,0|1,0,1]=4 334 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000210193 [0,1,1,0,0,0|1,0,1]=4 335 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000210193 [0,1,1,0,0,0|1,0,1]=4 336 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000210193 [0,1,1,0,0,0|1,0,1]=4 337 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000210193 [0,1,1,0,0,0|1,0,1]=4 338 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000210193 [0,1,1,0,0,0|1,0,1]=4 339 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000210193 [0,1,1,0,0,0|1,0,1]=4 340 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000210193 [0,1,1,0,0,0|1,0,1]=4 341 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000210193 [0,1,1,0,0,0|1,0,1]=4 342 B14R1.35 C=CCC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100000210193 [0,1,1,0,0,0|1,0,1]=4 343 B14R1.35 CC(C(=O)C=CBr)c1ccc(cc1)Br 1458a_100016273825_100000755118 [0,1,1,0,0,0|2,0,0]=4 344 B14R1.35 CC(C(=O)C=CBr)c1ccc(cc1)Cl 1458a_100016273825_100000684792 [0,1,1,0,0,0|2,0,0]=4 345 B14R1.35 CC(C(=O)C=CBr)c1ccc(cc1)F 1458a_100016273825_100000743420 [0,1,1,0,0,0|2,0,0]=4 346 B14R1.35 CC(C(=O)C=CCl)c1ccc(cc1)Br 1458a_200016279998_100000755118 [0,1,1,0,0,0|2,0,0]=4 347 B14R1.35 CC(C(=O)C=CCl)c1ccc(cc1)Cl 1458a_200016279998_100000684792 [0,1,1,0,0,0|2,0,0]=4 348 B14R1.35 CC(C(=O)C=CCl)c1ccc(cc1)F 1458a_200016279998_100000743420 [0,1,1,0,0,0|2,0,0]=4 349 B14R1.35 CC(C(=O)C=CI)c1ccc(cc1)Br 1458a_100016256311_100000755118 [0,1,1,0,0,0|2,0,0]=4 350 B14R1.35 CC(C(=O)C=CI)c1ccc(cc1)Cl 1458a_100016256311_100000684792 [0,1,1,0,0,0|2,0,0]=4 351 B14R1.35 CC(C(=O)C=CI)c1ccc(cc1)F 1458a_100016256311_100000743420 [0,1,1,0,0,0|2,0,0]=4 352 B14R1.35 CC=CC(=O)C(C)c1ccc(cc1)Br 1458a_100000210699_100000755118 [0,1,1,0,0,0|2,0,0]=4 353 B14R1.35 CC=CC(=O)C(C)c1ccc(cc1)C 1458a_100000210699_100011261388 [0,1,1,0,0,0|2,0,0]=4 354 B14R1.35 CC=CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000210699_100000684792 [0,1,1,0,0,0|2,0,0]=4 355 B14R1.35 CC=CC(=O)C(C)c1ccc(cc1)F 1458a_100000210699_100000743420 [0,1,1,0,0,0|2,0,0]=4 356 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000210699 [0,1,1,0,0,0|1,0,0]=3 357 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000210699 [0,1,1,0,0,0|1,0,0]=3 358 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000210699 [0,1,1,0,0,0|1,0,0]=3 359 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000210699 [0,1,1,0,0,0|1,0,0]=3 360 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000210699 [0,1,1,0,0,0|1,0,0]=3 361 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000210699 [0,1,1,0,0,0|1,0,0]=3 362 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000210699 [0,1,1,0,0,0|1,0,0]=3 363 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000210699 [0,1,1,0,0,0|1,0,0]=3 364 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000210699 [0,1,1,0,0,0|1,0,0]=3 365 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000210699 [0,1,1,0,0,0|1,0,0]=3 366 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000210699 [0,1,1,0,0,0|1,0,0]=3 367 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000210699 [0,1,1,0,0,0|1,0,0]=3 368 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000210699 [0,1,1,0,0,0|1,0,0]=3 369 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000210699 [0,1,1,0,0,0|1,0,0]=3 370 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000210699 [0,1,1,0,0,0|1,0,0]=3 371 B14R1.35 CC=CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000210699 [0,1,1,0,0,0|1,0,0]=3 372 B14R1.35 CN(C(=O)C=CBr)c1ccc(cc1)Br 1626a_100000219623_100016273825 [0,1,1,0,0,0|1,0,0]=3 373 B14R1.35 CN(C(=O)C=CBr)c1ccc(cc1)Cl 1626a_100020629279_100016273825 [0,1,1,0,0,0|1,0,0]=3 374 B14R1.35 CN(C(=O)C=CBr)c1ccc(cc1)F 1626a_100000219829_100016273825 [0,1,1,0,0,0|1,0,0]=3 375 B14R1.35 CN(C(=O)C=CBr)c1ccc(cc1)I 1626a_100000743151_100016273825 [0,1,1,0,0,0|1,0,0]=3 376 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)Br 11a_100000219623_200016279998 [0,1,1,0,0,0|1,0,0]=3 377 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)Br 1626a_100000219623_200016279998 [0,1,1,0,0,0|1,0,0]=3 378 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)Cl 11a_100020629279_200016279998 [0,1,1,0,0,0|1,0,0]=3 379 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)Cl 1626a_100020629279_200016279998 [0,1,1,0,0,0|1,0,0]=3 380 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)F 11a_100000219829_200016279998 [0,1,1,0,0,0|1,0,0]=3 381 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)F 1626a_100000219829_200016279998 [0,1,1,0,0,0|1,0,0]=3 382 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)I 11a_100000743151_200016279998 [0,1,1,0,0,0|1,0,0]=3 383 B14R1.35 CN(C(=O)C=CCl)c1ccc(cc1)I 1626a_100000743151_200016279998 [0,1,1,0,0,0|1,0,0]=3 384 B14R1.35 CN(C(=O)C=CI)c1ccc(cc1)Br 1626a_100000219623_100016256311 [0,1,1,0,0,0|1,0,0]=3 385 B14R1.35 CN(C(=O)C=CI)c1ccc(cc1)Cl 1626a_100020629279_100016256311 [0,1,1,0,0,0|1,0,0]=3 386 B14R1.35 CN(C(=O)C=CI)c1ccc(cc1)F 1626a_100000219829_100016256311 [0,1,1,0,0,0|1,0,0]=3 387 B14R1.35 CN(C(=O)C=CI)c1ccc(cc1)I 1626a_100000743151_100016256311 [0,1,1,0,0,0|1,0,0]=3 388 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)Br 22a_100000219623_100011216618 [0,1,1,0,0,0|0,0,2]=4 389 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)Cl 22a_100020629279_100011216618 [0,1,1,0,0,0|0,0,2]=4 390 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)F 22a_100000219829_100011216618 [0,1,1,0,0,0|0,0,2]=4 391 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)I 22a_100000743151_100011216618 [0,1,1,0,0,0|0,0,2]=4 392 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)O 22a_100000182112_100011216618 [0,1,1,0,0,0|0,0,2]=4 393 B14R1.35 Cc1ccc(cc1)C(C)C(=O)C=CBr 1458a_100016273825_100011261388 [0,1,1,0,0,0|2,0,0]=4 394 B14R1.35 Cc1ccc(cc1)C(C)C(=O)C=CCl 1458a_200016279998_100011261388 [0,1,1,0,0,0|2,0,0]=4 395 B14R1.35 Cc1ccc(cc1)C(C)C(=O)C=CI 1458a_100016256311_100011261388 [0,1,1,0,0,0|2,0,0]=4 396 B14R1.35 Cc1ccc(cc1)N(C)C(=O)C=CBr 1626a_100000219977_100016273825 [0,1,1,0,0,0|1,0,0]=3 397 B14R1.35 Cc1ccc(cc1)N(C)C(=O)C=CCl 11a_100000219977_200016279998 [0,1,1,0,0,0|1,0,0]=3 398 B14R1.35 Cc1ccc(cc1)N(C)C(=O)C=CCl 1626a_100000219977_200016279998 [0,1,1,0,0,0|1,0,0]=3 399 B14R1.35 Cc1ccc(cc1)N(C)C(=O)C=CI 1626a_100000219977_100016256311 [0,1,1,0,0,0|1,0,0]=3 400 B14R1.35 Cc1ccc(cc1)N(C)C(=O)CCO 22a_100000219977_100011216618 [0,1,1,0,0,0|0,0,2]=4 401 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100000210193 [0,1,1,0,0,0|1,0,1]=4 402 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100000210193 [0,1,1,0,0,0|1,0,1]=4 403 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000210193 [0,1,1,0,0,0|1,0,1]=4 404 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100000210193 [0,1,1,0,0,0|1,0,1]=4 405 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)C 11a_100000219674_100000210193 [0,1,1,0,0,0|1,0,1]=4 406 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100000210193 [0,1,1,0,0,0|1,0,1]=4 407 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000210193 [0,1,1,0,0,0|1,0,1]=4 408 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100000210193 [0,1,1,0,0,0|1,0,1]=4 409 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100000210193 [0,1,1,0,0,0|1,0,1]=4 410 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000210193 [0,1,1,0,0,0|1,0,1]=4 411 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)F 11a_100020633736_100000210193 [0,1,1,0,0,0|1,0,1]=4 412 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100000210193 [0,1,1,0,0,0|1,0,1]=4 413 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000210193 [0,1,1,0,0,0|1,0,1]=4 414 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)I 11a_100000221217_100000210193 [0,1,1,0,0,0|1,0,1]=4 415 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100000210193 [0,1,1,0,0,0|1,0,1]=4 416 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000210193 [0,1,1,0,0,0|1,0,1]=4 417 B14R1.36 C=CCC(=O)N(C)c1cccc(c1)O 527a_100000756613_100000210193 [0,1,1,0,0,0|1,0,1]=4 418 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100000210699 [0,1,1,0,0,0|1,0,0]=3 419 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100000210699 [0,1,1,0,0,0|1,0,0]=3 420 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000210699 [0,1,1,0,0,0|1,0,0]=3 421 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)C 11a_100000219674_100000210699 [0,1,1,0,0,0|1,0,0]=3 422 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100000210699 [0,1,1,0,0,0|1,0,0]=3 423 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000210699 [0,1,1,0,0,0|1,0,0]=3 424 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100000210699 [0,1,1,0,0,0|1,0,0]=3 425 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100000210699 [0,1,1,0,0,0|1,0,0]=3 426 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000210699 [0,1,1,0,0,0|1,0,0]=3 427 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)F 11a_100020633736_100000210699 [0,1,1,0,0,0|1,0,0]=3 428 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100000210699 [0,1,1,0,0,0|1,0,0]=3 429 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000210699 [0,1,1,0,0,0|1,0,0]=3 430 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)I 11a_100000221217_100000210699 [0,1,1,0,0,0|1,0,0]=3 431 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100000210699 [0,1,1,0,0,0|1,0,0]=3 432 B14R1.36 CC=CC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000210699 [0,1,1,0,0,0|1,0,0]=3 433 B14R1.36 CN(C(=O)C=CBr)c1cccc(c1)Br 1626a_100000219648_100016273825 [0,1,1,0,0,0|1,0,0]=3 434 B14R1.36 CN(C(=O)C=CBr)c1cccc(c1)Cl 1626a_100000220044_100016273825 [0,1,1,0,0,0|1,0,0]=3 435 B14R1.36 CN(C(=O)C=CBr)c1cccc(c1)F 1626a_100020633736_100016273825 [0,1,1,0,0,0|1,0,0]=3 436 B14R1.36 CN(C(=O)C=CBr)c1cccc(c1)I 1626a_100000221217_100016273825 [0,1,1,0,0,0|1,0,0]=3 437 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)Br 11a_100000219648_200016279998 [0,1,1,0,0,0|1,0,0]=3 438 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)Br 1626a_100000219648_200016279998 [0,1,1,0,0,0|1,0,0]=3 439 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)Cl 11a_100000220044_200016279998 [0,1,1,0,0,0|1,0,0]=3 440 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)Cl 1626a_100000220044_200016279998 [0,1,1,0,0,0|1,0,0]=3 441 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)F 11a_100020633736_200016279998 [0,1,1,0,0,0|1,0,0]=3 442 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)F 1626a_100020633736_200016279998 [0,1,1,0,0,0|1,0,0]=3 443 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)I 11a_100000221217_200016279998 [0,1,1,0,0,0|1,0,0]=3 444 B14R1.36 CN(C(=O)C=CCl)c1cccc(c1)I 1626a_100000221217_200016279998 [0,1,1,0,0,0|1,0,0]=3 445 B14R1.36 CN(C(=O)C=CI)c1cccc(c1)Br 1626a_100000219648_100016256311 [0,1,1,0,0,0|1,0,0]=3 446 B14R1.36 CN(C(=O)C=CI)c1cccc(c1)Cl 1626a_100000220044_100016256311 [0,1,1,0,0,0|1,0,0]=3 447 B14R1.36 CN(C(=O)C=CI)c1cccc(c1)F 1626a_100020633736_100016256311 [0,1,1,0,0,0|1,0,0]=3 448 B14R1.36 CN(C(=O)C=CI)c1cccc(c1)I 1626a_100000221217_100016256311 [0,1,1,0,0,0|1,0,0]=3 449 B14R1.36 CN(C(=O)CCO)c1cccc(c1)Br 22a_100000219648_100011216618 [0,1,1,0,0,0|0,0,2]=4 450 B14R1.36 CN(C(=O)CCO)c1cccc(c1)Cl 22a_100000220044_100011216618 [0,1,1,0,0,0|0,0,2]=4 451 B14R1.36 CN(C(=O)CCO)c1cccc(c1)F 22a_100020633736_100011216618 [0,1,1,0,0,0|0,0,2]=4 452 B14R1.36 CN(C(=O)CCO)c1cccc(c1)I 22a_100000221217_100011216618 [0,1,1,0,0,0|0,0,2]=4 453 B14R1.36 Cc1cccc(c1)N(C)C(=O)C=CBr 1626a_100000219674_100016273825 [0,1,1,0,0,0|1,0,0]=3 454 B14R1.36 Cc1cccc(c1)N(C)C(=O)C=CCl 11a_100000219674_200016279998 [0,1,1,0,0,0|1,0,0]=3 455 B14R1.36 Cc1cccc(c1)N(C)C(=O)C=CCl 1626a_100000219674_200016279998 [0,1,1,0,0,0|1,0,0]=3 456 B14R1.36 Cc1cccc(c1)N(C)C(=O)C=CI 1626a_100000219674_100016256311 [0,1,1,0,0,0|1,0,0]=3 457 B14R1.36 Cc1cccc(c1)N(C)C(=O)CCO 22a_100000219674_100011216618 [0,1,1,0,0,0|0,0,2]=4 458 B14R1.166 C/C=C/CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100102629194 [0,1,1,0,0,0|2,0,0]=4 459 B14R1.166 C=CC=CC(=O)C(C)c1ccccc1 1458a_100016291481_100000230085 [0,1,1,0,0,0|2,0,0]=4 460 B14R1.166 C=CC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100016291481 [0,1,1,0,0,0|1,0,0]=3 461 B14R1.166 C=CC=CC(=O)N(C)c1ccccc1 22a_100000210012_100016291481 [0,1,1,0,0,0|1,0,0]=3 462 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749702 [0,1,1,0,0,0|1,0,1]=4 463 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749702 [0,1,1,0,0,0|1,0,1]=4 464 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749702 [0,1,1,0,0,0|1,0,1]=4 465 B14R1.166 C=CCNC(=O)N(C)c1ccccc1 512a_100020586998_100000210012 [0,1,1,0,0,0|1,0,1]=4 466 B14R1.166 CC=CCC(=O)C(C)c1ccccc1 1458a_100121576822_100000230085 [0,1,1,0,0,0|2,0,0]=4 467 B14R1.166 CC=CCC(=O)N(C)c1ccccc1 11a_100000210012_100121576822 [0,1,1,0,0,0|1,0,0]=3 468 B14R1.166 CC=CCC(=O)N(C)c1ccccc1 1626a_100000210012_100121576822 [0,1,1,0,0,0|1,0,0]=3 469 B14R1.166 CC=CCC(=O)N(C)c1ccccc1 22a_100000210012_100121576822 [0,1,1,0,0,0|1,0,0]=3 470 B14R1.166 CC=CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000070051 [0,1,1,0,0,0|2,0,0]=4 471 B14R1.166 CCC=CC(=O)C(C)c1ccccc1 1458a_100000212282_100000230085 [0,1,1,0,0,0|2,0,0]=4 472 B14R1.166 CCC=CC(=O)N(C)c1ccccc1 11a_100000210012_100000212282 [0,1,1,0,0,0|1,0,0]=3 473 B14R1.166 CCC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000212282 [0,1,1,0,0,0|1,0,0]=3 474 B14R1.166 CCC=CC(=O)N(C)c1ccccc1 22a_100000210012_100000212282 [0,1,1,0,0,0|1,0,0]=3 475 B14R1.166 COC=CC(=O)C(C)c1ccccc1 1458a_100016268678_100000230085 [0,1,1,0,0,0|1,0,0]=3 476 B14R1.166 COC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100016268678 [0,1,1,0,0,0|0,0,0]=2 477 B14R1.166 COC=CC(=O)N(C)c1ccccc1 22a_100000210012_100016268678 [0,1,1,0,0,0|0,0,0]=2 478 B14R1.166 COCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749529 [0,1,1,0,0,0|0,0,2]=4 479 B14R1.166 COCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749529 [0,1,1,0,0,0|0,0,2]=4 480 B14R1.166 COCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749529 [0,1,1,0,0,0|0,0,2]=4 481 B14R1.166 COCCC(=O)N(C)c1ccccc1 34a_100138415774_100000691765 [0,1,1,0,0,0|0,0,2]=4 482 B14R1.417 CC(=CC(=O)C(C)c1ccccc1)C 1458a_100000211388_100000230085 [0,1,1,0,0,0|2,0,0]=4 483 B14R1.417 CC(=CC(=O)C(C)c1ccccc1)Cl 1458a_200042562850_100000230085 [0,1,1,0,0,0|2,0,0]=4 484 B14R1.417 CC(=CC(=O)C(C)c1ccccc1)I 1458a_100025716642_100000230085 [0,1,1,0,0,0|2,0,0]=4 485 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)C 11a_100000210012_100000211388 [0,1,1,0,0,0|1,0,0]=3 486 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)C 1626a_100000210012_100000211388 [0,1,1,0,0,0|1,0,0]=3 487 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)C 22a_100000210012_100000211388 [0,1,1,0,0,0|1,0,0]=3 488 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)Cl 11a_100000210012_200042562850 [0,1,1,0,0,0|1,0,0]=3 489 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)Cl 1626a_100000210012_200042562850 [0,1,1,0,0,0|1,0,0]=3 490 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)Cl 22a_100000210012_200042562850 [0,1,1,0,0,0|1,0,0]=3 491 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)I 11a_100000210012_100025716642 [0,1,1,0,0,0|1,0,0]=3 492 B14R1.417 CC(=CC(=O)N(C)c1ccccc1)I 1626a_100000210012_100025716642 [0,1,1,0,0,0|1,0,0]=3 493 B14R1.417 CC(=O)CC(=O)N(C)c1ccccc1 1458a_100000070787_100000183487 [0,1,1,0,0,0|0,0,2]=4 494 B14R1.417 CC(C(=O)C=C(Cl)Cl)c1ccccc1 1458a_100000137448_100000230085 [0,1,1,0,0,0|2,0,0]=4 495 B14R1.417 CN(C(=O)C=C(Cl)Cl)c1ccccc1 1626a_100000210012_100000137448 [0,1,1,0,0,0|1,0,0]=3 496 B14R1.417 CN(C(=O)CC(=O)N)c1ccccc1 22a_100000210012_100134613110 [0,1,1,0,0,0|0,0,2]=4 497 B14R1.417 C[C@@H](O)CC(=O)N(C)c1ccccc1 22a_100000210012_100011933948 [0,1,1,0,0,0|0,0,2]=4 498 B14R1.510 CC(C)(C(=O)C=CBr)c1ccccc1 1458a_100016273825_100000034625 [0,1,1,0,0,0|2,0,0]=4 499 B14R1.510 CC(C)(C(=O)C=CCl)c1ccccc1 1458a_200016279998_100000034625 [0,1,1,0,0,0|2,0,0]=4 500 B14R1.510 CC(C)(C(=O)C=CI)c1ccccc1 1458a_100016256311_100000034625 [0,1,1,0,0,0|2,0,0]=4 501 B14R1.510 CC=CC(=O)C(C)(C)c1ccccc1 1458a_100000210699_100000034625 [0,1,1,0,0,0|2,0,0]=4 502 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210193 [0,1,1,0,0,0|1,0,1]=4 503 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210193 [0,1,1,0,0,0|1,0,1]=4 504 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210193 [0,1,1,0,0,0|1,0,1]=4 505 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 11a_100000210013_100000210699 [0,1,1,0,0,0|1,0,0]=3 506 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210699 [0,1,1,0,0,0|1,0,0]=3 507 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 22a_100000210013_100000210699 [0,1,1,0,0,0|1,0,0]=3 508 B14R1.604 CCN(C(=O)C=CBr)c1ccccc1 1626a_100000210013_100016273825 [0,1,1,0,0,0|1,0,0]=3 509 B14R1.604 CCN(C(=O)C=CCl)c1ccccc1 11a_100000210013_200016279998 [0,1,1,0,0,0|1,0,0]=3 510 B14R1.604 CCN(C(=O)C=CCl)c1ccccc1 1626a_100000210013_200016279998 [0,1,1,0,0,0|1,0,0]=3 511 B14R1.604 CCN(C(=O)C=CI)c1ccccc1 1626a_100000210013_100016256311 [0,1,1,0,0,0|1,0,0]=3 512 B14R1.604 CCN(C(=O)CCO)c1ccccc1 22a_100000210013_100011216618 [0,1,1,0,0,0|0,0,2]=4 513 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210193 [0,1,1,0,0,0|1,0,1]=4 514 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210193 [0,1,1,0,0,0|1,0,1]=4 515 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210193 [0,1,1,0,0,0|1,0,1]=4 516 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210193 [0,1,1,0,0,0|1,0,1]=4 517 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210193 [0,1,1,0,0,0|1,0,1]=4 518 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210193 [0,1,1,0,0,0|1,0,1]=4 519 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210193 [0,1,1,0,0,0|1,0,1]=4 520 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210193 [0,1,1,0,0,0|1,0,1]=4 521 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210193 [0,1,1,0,0,0|1,0,1]=4 522 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210193 [0,1,1,0,0,0|1,0,1]=4 523 B14R1.3348 C=CCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210193 [0,1,1,0,0,0|1,0,1]=4 524 B14R1.3348 C=CCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210193 [0,1,1,0,0,0|1,0,1]=4 525 B14R1.3348 CC(C(=O)C=CBr)c1ccccc1Cl 1458a_100016273825_100000181259 [0,1,1,0,0,0|2,0,0]=4 526 B14R1.3348 CC(C(=O)C=CBr)c1ccccc1F 1458a_100016273825_200000741388 [0,1,1,0,0,0|2,0,0]=4 527 B14R1.3348 CC(C(=O)C=CCl)c1ccccc1Cl 1458a_200016279998_100000181259 [0,1,1,0,0,0|2,0,0]=4 528 B14R1.3348 CC(C(=O)C=CCl)c1ccccc1F 1458a_200016279998_200000741388 [0,1,1,0,0,0|2,0,0]=4 529 B14R1.3348 CC(C(=O)C=CI)c1ccccc1Cl 1458a_100016256311_100000181259 [0,1,1,0,0,0|2,0,0]=4 530 B14R1.3348 CC(C(=O)C=CI)c1ccccc1F 1458a_100016256311_200000741388 [0,1,1,0,0,0|2,0,0]=4 531 B14R1.3348 CC=CC(=O)C(C)c1ccccc1Cl 1458a_100000210699_100000181259 [0,1,1,0,0,0|2,0,0]=4 532 B14R1.3348 CC=CC(=O)C(C)c1ccccc1F 1458a_100000210699_200000741388 [0,1,1,0,0,0|2,0,0]=4 533 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210699 [0,1,1,0,0,0|1,0,0]=3 534 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210699 [0,1,1,0,0,0|1,0,0]=3 535 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 11a_100000219699_100000210699 [0,1,1,0,0,0|1,0,0]=3 536 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210699 [0,1,1,0,0,0|1,0,0]=3 537 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 22a_100000219699_100000210699 [0,1,1,0,0,0|1,0,0]=3 538 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210699 [0,1,1,0,0,0|1,0,0]=3 539 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210699 [0,1,1,0,0,0|1,0,0]=3 540 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 11a_100000220357_100000210699 [0,1,1,0,0,0|1,0,0]=3 541 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210699 [0,1,1,0,0,0|1,0,0]=3 542 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 22a_100000220357_100000210699 [0,1,1,0,0,0|1,0,0]=3 543 B14R1.3348 CC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000210699 [0,1,1,0,0,0|1,0,0]=3 544 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1Br 1626a_100020606079_100016273825 [0,1,1,0,0,0|1,0,0]=3 545 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1Cl 1626a_100000219374_100016273825 [0,1,1,0,0,0|1,0,0]=3 546 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1F 1626a_100000220357_100016273825 [0,1,1,0,0,0|1,0,0]=3 547 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Br 11a_100020606079_200016279998 [0,1,1,0,0,0|1,0,0]=3 548 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Br 1626a_100020606079_200016279998 [0,1,1,0,0,0|1,0,0]=3 549 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Cl 11a_100000219374_200016279998 [0,1,1,0,0,0|1,0,0]=3 550 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Cl 1626a_100000219374_200016279998 [0,1,1,0,0,0|1,0,0]=3 551 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1F 11a_100000220357_200016279998 [0,1,1,0,0,0|1,0,0]=3 552 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1F 1626a_100000220357_200016279998 [0,1,1,0,0,0|1,0,0]=3 553 B14R1.3348 CN(C(=O)C=CI)c1ccccc1Br 1626a_100020606079_100016256311 [0,1,1,0,0,0|1,0,0]=3 554 B14R1.3348 CN(C(=O)C=CI)c1ccccc1Cl 1626a_100000219374_100016256311 [0,1,1,0,0,0|1,0,0]=3 555 B14R1.3348 CN(C(=O)C=CI)c1ccccc1F 1626a_100000220357_100016256311 [0,1,1,0,0,0|1,0,0]=3 556 B14R1.3348 CN(C(=O)CCO)c1ccccc1F 22a_100000220357_100011216618 [0,1,1,0,0,0|0,0,2]=4 557 B14R1.3348 CN(C(=O)CCO)c1ccccc1O 22a_100000033821_100011216618 [0,1,1,0,0,0|0,0,2]=4 558 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CBr 1626a_100000219699_100016273825 [0,1,1,0,0,0|1,0,0]=3 559 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CCl 11a_100000219699_200016279998 [0,1,1,0,0,0|1,0,0]=3 560 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CCl 1626a_100000219699_200016279998 [0,1,1,0,0,0|1,0,0]=3 561 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CI 1626a_100000219699_100016256311 [0,1,1,0,0,0|1,0,0]=3 562 B14R1.3348 Cc1ccccc1N(C)C(=O)CCO 22a_100000219699_100011216618 [0,1,1,0,0,0|0,0,2]=4 563 B14R1.95 C=CC(=O)N(C)c1ccccc1C#N 1626a_100000744078_100000185746 [0,1,1,0,0,0|1,0,1]=4 564 B14R1.95 C=CC(=O)N(C)c1ccccc1OC 1626a_100000219746_100000185746 [0,1,1,0,0,0|2,0,0]=4 565 B14R1.95 C=CC(=O)N(C)c1ccccc1OC 22a_100000219746_100000185746 [0,1,1,0,0,0|2,0,0]=4 566 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 11a_100000184419_100015343762 [0,1,1,0,0,0|0,0,2]=4 567 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 1626a_100000184419_100015343762 [0,1,1,0,0,0|0,0,2]=4 568 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)[13CH3] 1458a_100000242783_200025704644 [0,1,1,0,0,0|0,0,2]=4 569 B14R1.429 CC(=O)c1ccccc1N(C)C(=O)C 1458a_100000242783_200000210301 [0,1,1,0,0,0|0,0,2]=4 570 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [1,1,0,0,0,0|2,0,0]=4 571 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [1,1,0,0,0,0|1,0,1]=4 572 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [1,1,0,0,0,0|1,0,1]=4 573 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [1,1,0,0,0,0|1,1,0]=4 574 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [1,1,0,0,0,0|1,1,0]=4 575 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [1,1,0,0,0,0|1,0,1]=4 576 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [1,1,0,0,0,0|1,0,1]=4 577 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [1,1,0,0,0,0|1,1,0]=4 578 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [1,1,0,0,0,0|1,1,0]=4 579 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [1,1,0,0,0,0|2,0,0]=4 580 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [1,1,0,0,0,0|2,0,0]=4 581 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [1,1,0,0,0,0|2,0,0]=4 582 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [1,1,0,0,0,0|2,0,0]=4 583 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [1,1,0,0,0,0|1,0,1]=4 584 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [1,1,0,0,0,0|2,0,0]=4 585 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [1,1,0,0,0,0|2,0,0]=4 586 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [1,1,0,0,0,0|2,0,0]=4 587 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [1,1,0,0,0,0|2,0,0]=4 588 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [1,1,0,0,0,0|2,0,0]=4 589 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [1,1,0,0,0,0|1,0,1]=4 590 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [1,1,0,0,0,0|2,0,0]=4 591 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [1,1,0,0,0,0|2,0,0]=4 592 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [1,1,0,0,0,0|2,0,0]=4 593 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [1,1,0,0,0,0|2,0,0]=4 594 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [1,1,0,0,0,0|2,0,0]=4 595 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [1,1,0,0,0,0|2,0,0]=4 596 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [1,1,0,0,0,0|1,0,1]=4 597 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [1,1,0,0,0,0|2,0,0]=4 598 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [1,1,0,0,0,0|2,0,0]=4 599 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [1,1,0,0,0,0|2,0,0]=4 600 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [1,1,0,0,0,0|2,0,0]=4 601 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [1,1,0,0,0,0|2,0,0]=4 602 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [1,1,0,0,0,0|2,0,0]=4 603 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [1,1,0,0,0,0|2,0,0]=4 604 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [1,1,0,0,0,0|1,0,1]=4 605 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [1,1,0,0,0,0|2,0,0]=4 606 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [1,1,0,0,0,0|2,0,0]=4 607 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [1,1,0,0,0,0|2,0,0]=4 608 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [1,1,0,0,0,0|2,0,0]=4 609 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [1,1,0,0,0,0|2,0,0]=4 610 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [1,1,0,0,0,0|2,0,0]=4 611 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [1,1,0,0,0,0|2,0,0]=4 612 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [1,1,0,0,0,0|1,0,1]=4 613 B14R2.4513 CN1C(=O)COc2c1cc(cc2)O 271570a_203496583355_100010196913 [1,1,0,0,0,0|1,0,1]=4 614 B14R2.4513 Cn1c(=O)ccc2c1cc(cc2)O 271570a_203496583355_200010167779 [1,1,0,0,0,0|0,0,0]=2 615 B14R2.4513 Cn1c(=O)cnc2c1cc(cc2)O 271570a_203496583355_100010221214 [1,1,0,0,0,0|1,0,0]=3 616 B14R2.29369 CN1C(=O)CCc2c1ccc(c2)O 271570a_203496583355_100000699942 [1,1,0,0,0,0|0,0,2]=4 617 B14R2.29369 CN1C(=O)COc2c1ccc(c2)O 271570a_203496583355_100010240413 [1,1,0,0,0,0|1,0,1]=4 618 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [1,1,0,0,0,0|2,0,0]=4 619 B14R2.1019 C=Cc1cc(=O)c2ccccc2[nH]1 271570a_100011290941_100000090176 [1,1,0,0,0,0|1,0,1]=4 620 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [1,1,0,0,0,0|2,0,0]=4 621 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [1,1,0,0,0,0|1,0,1]=4 622 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [1,1,0,0,0,0|0,0,2]=4 623 B14R2.1019 CSc1cc(=O)c2ccccc2[nH]1 62a_200000210301_100000090176 [1,1,0,0,0,0|0,1,1]=4 624 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [1,1,0,0,0,0|1,1,0]=4 625 B14R2.1019 [13CH3]Sc1cc(=O)c2ccccc2[nH]1 62a_200025704644_100000090176 [1,1,0,0,0,0|0,1,1]=4 626 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [1,1,0,0,0,0|1,1,0]=4 627 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccc2 271570a_100011290941_100000075698 [1,1,0,0,0,0|1,0,0]=3 628 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccn2 271570a_100011290941_100010499609 [1,1,0,0,0,0|2,0,0]=4 629 B14R2.1146 CNc1cc(=O)[nH]c2c1cccc2 27a_100102657272_100000075698 [1,1,0,0,0,0|1,0,0]=3 630 B14R2.1146 CNc1cc(=O)[nH]c2c1cccn2 27a_100102657272_100010499609 [1,1,0,0,0,0|2,0,0]=4 631 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [1,1,0,0,0,0|2,0,0]=4 632 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [1,1,0,0,0,0|2,0,0]=4 633 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [1,1,0,0,0,0|1,0,1]=4 634 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [1,1,0,0,0,0|0,0,2]=4 635 B14R2.1146 CSc1cc(=O)[nH]c2c1cccc2 62a_200000210301_100000075698 [1,1,0,0,0,0|0,1,0]=3 636 B14R2.1146 CSc1cc(=O)[nH]c2c1cccn2 62a_200000210301_100010499609 [1,1,0,0,0,0|1,1,0]=4 637 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [1,1,0,0,0,0|1,0,1]=4 638 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [1,1,0,0,0,0|2,0,0]=4 639 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [1,1,0,0,0,0|2,0,0]=4 640 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccc2 62a_200025704644_100000075698 [1,1,0,0,0,0|0,1,0]=3 641 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccn2 62a_200025704644_100010499609 [1,1,0,0,0,0|1,1,0]=4 642 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [1,1,0,0,0,0|1,0,1]=4 643 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [1,1,0,0,0,0|1,0,1]=4 644 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [1,1,0,0,0,0|1,0,1]=4 645 B14R2.8045 O=c1[nH]c(=O)c2cccc(c2[nH]1)O 271570a_203496583355_100012357391 [1,1,0,0,0,0|1,0,1]=4 646 B14R2.8045 O=c1[nH]c2c(cccc2c(=O)o1)O 271570a_203496583355_100000695655 [1,1,0,0,0,0|1,0,1]=4 647 B14R2.8045 O=c1cc(c2cccc(c2[nH]1)O)O 271570a_203496583355_200010201894 [1,1,0,0,0,0|0,0,0]=2 648 B14R2.8235 Cc1cc(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100009820897 [1,1,0,0,0,0|1,0,0]=3 649 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011333642 [1,1,0,0,0,0|1,0,1]=4 650 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O 271570a_203496583355_100000689691 [1,1,0,0,0,0|1,0,1]=4 651 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [1,1,0,0,0,0|1,0,1]=4 652 B14R2.8235 O=c1[nH]c(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011934062 [1,1,0,0,0,0|1,0,1]=4 653 B14R2.8235 O=c1[nH]c2ccc(cc2c(=O)o1)O 271570a_203496583355_100000216498 [1,1,0,0,0,0|1,0,1]=4 654 B14R2.8235 O=c1cc(c2cc(ccc2[nH]1)O)O 271570a_203496583355_100000695641 [1,1,0,0,0,0|0,0,0]=2 655 B14R2.8235 O=c1cc(c2cc(ccc2o1)O)O 271570a_203496583355_100009814091 [1,1,0,0,0,0|1,0,0]=3 656 B14R2.28480 O=c1[nH]c2cccc(c2c(=O)o1)O 271570a_203496583355_100010201677 [1,1,0,0,0,0|1,0,1]=4 657 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [1,1,0,0,0,0|1,0,1]=4 658 B14R2.29365 O=c1[nH]c(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100012351534 [1,1,0,0,0,0|1,0,1]=4 659 B14R2.29365 O=c1[nH]c2cc(ccc2c(=O)o1)O 271570a_203496583355_100000723304 [1,1,0,0,0,0|1,0,1]=4 660 B14R2.29365 O=c1cc(c2ccc(cc2o1)O)O 271570a_203496583355_100010062223 [1,1,0,0,0,0|1,0,0]=3 661 B14R2.1131 C=Cc1ccc(c2c1cccc2)C 271570a_100011290941_100011215156 [1,1,0,0,0,0|2,0,0]=4 662 B14R2.1131 C=Cc1ccc(c2c1cccc2)O 271570a_100011290941_100000186334 [1,1,0,0,0,0|1,0,1]=4 663 B14R2.1131 CNc1ccc(c2c1cccc2)Br 34a_100000766797_200000210301 [1,1,0,0,0,0|2,0,0]=4 664 B14R2.1131 CNc1ccc(c2c1cccc2)Cl 34a_100011216319_200000210301 [1,1,0,0,0,0|2,0,0]=4 665 B14R2.1131 CNc1ccc(c2c1cccc2)F 34a_100011988692_200000210301 [1,1,0,0,0,0|2,0,0]=4 666 B14R2.1131 CNc1ccc(c2c1cccc2)O 34a_100000705857_200000210301 [1,1,0,0,0,0|1,0,0]=3 667 B14R2.1131 CNc1ccc(c2c1cccn2)O 34a_100000188197_200000210301 [1,1,0,0,0,0|2,0,0]=4 668 B14R2.1131 COc1ccc(c2c1cccc2)Br 34a_100000186334_200000210301 [1,1,0,0,0,0|2,0,0]=4 669 B14R2.1131 COc1ccc(c2c1cccc2)Br 7a_100000186334_200000210301 [1,1,0,0,0,0|2,0,0]=4 670 B14R2.1131 COc1ccc(c2c1cccc2)C 34a_100000074455_200000210301 [1,1,0,0,0,0|1,0,0]=3 671 B14R2.1131 COc1ccc(c2c1cccc2)C 7a_100000074455_200000210301 [1,1,0,0,0,0|1,0,0]=3 672 B14R2.1131 COc1ccc(c2c1cccc2)Cl 34a_100000211000_200000210301 [1,1,0,0,0,0|2,0,0]=4 673 B14R2.1131 COc1ccc(c2c1cccc2)Cl 7a_100000211000_200000210301 [1,1,0,0,0,0|2,0,0]=4 674 B14R2.1131 COc1ccc(c2c1cccc2)F 34a_100000100223_200000210301 [1,1,0,0,0,0|2,0,0]=4 675 B14R2.1131 COc1ccc(c2c1cccc2)F 7a_100000100223_200000210301 [1,1,0,0,0,0|2,0,0]=4 676 B14R2.1131 COc1ccc(c2c1cccc2)N 34a_100000705857_200000210301 [1,1,0,0,0,0|2,0,0]=4 677 B14R2.1131 COc1ccc(c2c1cccc2)N 7a_100000705857_200000210301 [1,1,0,0,0,0|2,0,0]=4 678 B14R2.1131 COc1ccc(c2c1cccc2)O 271570a_203496583355_100011256618 [1,1,0,0,0,0|1,0,0]=3 679 B14R2.1131 COc1ccc(c2c1nccc2)C 34a_100000058672_200000210301 [1,1,0,0,0,0|2,0,0]=4 680 B14R2.1131 COc1ccc(c2c1nccc2)C 7a_100000058672_200000210301 [1,1,0,0,0,0|2,0,0]=4 681 B14R2.1131 COc1ccc(c2c1nccc2)O 271570a_203496583355_100009820878 [1,1,0,0,0,0|2,0,0]=4 682 B14R2.1131 COc1cnc(c2c1cccc2)O 271570a_203496583355_100009847308 [1,1,0,0,0,0|2,0,0]=4 683 B14R2.1131 COc1ncc(c2c1cccc2)O 271570a_203496583355_100010220697 [1,1,0,0,0,0|2,0,0]=4 684 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_100012339872_200000210301 [1,1,0,0,0,0|2,0,0]=4 685 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_200000210301_100012339872 [1,1,0,0,0,0|2,0,0]=4 686 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_100011215156_200000210301 [1,1,0,0,0,0|1,1,0]=4 687 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_200000210301_100011215156 [1,1,0,0,0,0|1,1,0]=4 688 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_100011218216_200000210301 [1,1,0,0,0,0|2,0,0]=4 689 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_200000210301_100011218216 [1,1,0,0,0,0|2,0,0]=4 690 B14R2.1131 CSc1ccc(c2c1cccc2)N 62a_100000766797_200000210301 [1,1,0,0,0,0|2,0,0]=4 691 B14R2.1131 CSc1ccc(c2c1cccc2)O 62a_200000210301_100000186334 [1,1,0,0,0,0|1,0,0]=3 692 B14R2.1131 CSc1ccc(c2c1cccn2)O 62a_200000210301_100011934063 [1,1,0,0,0,0|2,0,0]=4 693 B14R2.1131 CSc1cnc(c2c1cccc2)O 62a_200000210301_100009816523 [1,1,0,0,0,0|2,0,0]=4 694 B14R2.1131 CSc1ncc(c2c1cccc2)O 62a_200000210301_100000067196 [1,1,0,0,0,0|2,0,0]=4 695 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 34a_100000074455_200025704644 [1,1,0,0,0,0|1,0,0]=3 696 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 7a_100000074455_200025704644 [1,1,0,0,0,0|1,0,0]=3 697 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_100011215156_200025704644 [1,1,0,0,0,0|1,1,0]=4 698 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_200025704644_100011215156 [1,1,0,0,0,0|1,1,0]=4 699 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 34a_100000058672_200025704644 [1,1,0,0,0,0|2,0,0]=4 700 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 7a_100000058672_200025704644 [1,1,0,0,0,0|2,0,0]=4 701 B14R2.1131 N#Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012344970 [1,1,0,0,0,0|1,0,1]=4 702 B14R2.1131 NCc1ccc(c2c1cccc2)O 271570a_203496583355_100016995114 [1,1,0,0,0,0|1,0,0]=3 703 B14R2.1131 O=Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012359940 [1,1,0,0,0,0|1,0,1]=4 704 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Br 34a_100000766797_200025704644 [1,1,0,0,0,0|2,0,0]=4 705 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Cl 34a_100011216319_200025704644 [1,1,0,0,0,0|2,0,0]=4 706 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)F 34a_100011988692_200025704644 [1,1,0,0,0,0|2,0,0]=4 707 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)O 34a_100000705857_200025704644 [1,1,0,0,0,0|1,0,0]=3 708 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)O 34a_100000188197_200025704644 [1,1,0,0,0,0|2,0,0]=4 709 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 34a_100000186334_200025704644 [1,1,0,0,0,0|2,0,0]=4 710 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 7a_100000186334_200025704644 [1,1,0,0,0,0|2,0,0]=4 711 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 34a_100000211000_200025704644 [1,1,0,0,0,0|2,0,0]=4 712 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 7a_100000211000_200025704644 [1,1,0,0,0,0|2,0,0]=4 713 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 34a_100000100223_200025704644 [1,1,0,0,0,0|2,0,0]=4 714 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 7a_100000100223_200025704644 [1,1,0,0,0,0|2,0,0]=4 715 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 34a_100000705857_200025704644 [1,1,0,0,0,0|2,0,0]=4 716 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 7a_100000705857_200025704644 [1,1,0,0,0,0|2,0,0]=4 717 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_100012339872_200025704644 [1,1,0,0,0,0|2,0,0]=4 718 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_200025704644_100012339872 [1,1,0,0,0,0|2,0,0]=4 719 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_100011218216_200025704644 [1,1,0,0,0,0|2,0,0]=4 720 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_200025704644_100011218216 [1,1,0,0,0,0|2,0,0]=4 721 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)N 62a_100000766797_200025704644 [1,1,0,0,0,0|2,0,0]=4 722 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)O 62a_200025704644_100000186334 [1,1,0,0,0,0|1,0,0]=3 723 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)O 62a_200025704644_100011934063 [1,1,0,0,0,0|2,0,0]=4 724 B14R2.1131 [13CH3]Sc1cnc(c2c1cccc2)O 62a_200025704644_100009816523 [1,1,0,0,0,0|2,0,0]=4 725 B14R2.1131 [13CH3]Sc1ncc(c2c1cccc2)O 62a_200025704644_100000067196 [1,1,0,0,0,0|2,0,0]=4 726 B14R2.8051 Cc1ccnc2c1c(ccc2O)C 271570a_203496583355_200010761301 [1,1,0,0,0,0|2,0,0]=4 727 B14R2.8716 CN1C(=O)C(=O)c2c1cc(cc2)O 271570a_203496583355_100011232274 [0,1,0,0,1,0|0,0,1]=3 728 B14R2.8716 CN1C(=O)C(=O)c2c1ccc(c2)O 271570a_203496583355_100000187606 [0,1,0,0,1,0|0,0,1]=3 729 B16R2.8682 C=Cc1c(c2ccccc2n(c1=O)C)C 271570a_100011290941_100010739255 [0,2,0,0,0,0|1,0,0]=3 730 B16R2.8682 CSc1c(c2ccccc2n(c1=O)C)C 62a_100010739255_200000210301 [0,2,0,0,0,0|1,0,0]=3 731 B16R2.8682 CSc1c(c2ccccc2n(c1=O)C)C 62a_200000210301_100010739255 [0,2,0,0,0,0|1,0,0]=3 732 B16R2.8682 Cc1c(c(=O)n(c2c1cccc2)C)S[13CH3] 62a_100010739255_200025704644 [0,2,0,0,0,0|1,0,0]=3 733 B16R2.8682 Cc1c(c(=O)n(c2c1cccc2)C)S[13CH3] 62a_200025704644_100010739255 [0,2,0,0,0,0|1,0,0]=3 734 B16R2.8682 Cn1c(=O)c(c(c2c1cccc2)O)C=O 271570a_203496583355_200000050653 [0,2,0,0,0,0|0,0,0]=2 735 B16R2.133343 Cn1c(=O)c(=O)n(c2c1ccc(c2)O)C 271570a_203496583355_100009998746 [0,2,0,0,0,0|2,0,0]=4 736 B16R2.133137 Cn1c(=O)oc(=O)c2c1ccc(c2F)O 271570a_203496583355_100020620177 [0,2,0,0,0,0|1,0,1]=4 737 B16R2.23331 CC(=O)c1cc(c2ccccc2c1O)O 1458a_100000212128_200000210301 [0,2,0,0,0,0|2,0,0]=4 738 B16R2.23331 [13CH3]C(=O)c1cc(c2ccccc2c1O)O 1458a_100000212128_200025704644 [0,2,0,0,0,0|2,0,0]=4 739 B16R2.22312 C=C(C)c1cc(=O)n(c2c1cccc2)C 271570a_100000694244_100000041018 [0,2,0,0,0,0|1,0,0]=3 740 B16R2.22312 CN(C)c1cc(=O)n(c2c1cccc2)C 27a_100102631434_100000041018 [0,2,0,0,0,0|1,0,0]=3 741 B16R2.50940 C=C=Cc1cc(=O)n(c2c1cccc2)C 271570a_100015277604_100000041018 [0,2,0,0,0,0|1,0,0]=3 742 B16R2.50940 CC=Cc1cc(=O)n(c2c1cccc2)C 271570a_100016259895_100000041018 [0,2,0,0,0,0|1,0,0]=3 743 B16R2.50940 CCNc1cc(=O)n(c2c1cccc2)C 27a_100015525214_100000041018 [0,2,0,0,0,0|1,0,0]=3 744 B16R2.50940 CCSc1cc(=O)n(c2c1cccc2)C 62a_100000210202_100000041018 [0,2,0,0,0,0|0,1,0]=3 745 B16R2.50940 CCSc1cc(=O)n(c2c1cccc2)C 62a_100010246319_100000210202 [0,2,0,0,0,0|0,1,0]=3 746 B16R2.50940 Cn1c(=O)cc(c2c1cccc2)SCF 62a_100010246319_100015361967 [0,2,0,0,0,0|0,1,0]=3 747 B16R2.50940 Cn1c(=O)cc(c2c1cccc2)SCF 62a_100015361967_100000041018 [0,2,0,0,0,0|0,1,0]=3 748 B16R2.196882 C=Cc1ccc2c(c1)c(=O)oc(=O)n2C 271570a_100011290941_100009812665 [0,2,0,0,0,0|1,0,1]=4 749 B14R2.8 CNc1noc(n1)c2ccccc2 27a_100102657272_200000701163 [0,0,1,1,0,0|2,0,0]=4 750 B14R2.8 CSc1cc(on1)c2ccccc2 62a_200000210301_200010138274 [0,0,1,1,0,0|2,0,0]=4 751 B14R2.8 CSc1cc(on1)c2ccccc2 62a_200010138274_200000210301 [0,0,1,1,0,0|2,0,0]=4 752 B14R2.8 [13CH3]Sc1cc(on1)c2ccccc2 62a_200010138274_200025704644 [0,0,1,1,0,0|2,0,0]=4 753 B14R2.8 [13CH3]Sc1cc(on1)c2ccccc2 62a_200025704644_200010138274 [0,0,1,1,0,0|2,0,0]=4 754 B14R2.21 O=C1C=C(CCC1)c2ccccc2 271570a_100000723966_100000210277 [0,0,1,1,0,0|2,0,0]=4 755 B14R2.21 O=c1cc(cc[nH]1)c2ccccc2 271570a_100011218836_100009816521 [0,0,1,1,0,0|1,0,1]=4 756 B14R2.21 O=c1cc(cn[nH]1)c2ccccc2 271570a_100011218836_100010197405 [0,0,1,1,0,0|2,0,0]=4 757 B14R2.260 Cc1cc(nn1C)c2ccccc2 271570a_100011218836_100012001299 [0,0,1,1,0,0|2,0,0]=4 758 B14R2.260 Cn1nc(cc1N)c2ccccc2 271570a_100011218836_100000734454 [0,0,1,1,0,0|2,0,0]=4 759 B14R2.44 CC=Cc1nc2ccccc2n1C 271570a_100016259895_200000239431 [0,0,1,1,0,0|2,0,0]=4 760 B14R2.15694 CN(C(=O)C1CO1)c2ccccc2 11a_100000210012_100000701028 [0,0,1,1,0,0|0,0,2]=4 761 B14R2.15694 CN(C(=O)C1CO1)c2ccccc2 1626a_100000210012_100000701028 [0,0,1,1,0,0|0,0,2]=4 762 B14R2.15694 CN(C(=O)C1CO1)c2ccccc2 22a_100000210012_100000701028 [0,0,1,1,0,0|0,0,2]=4 763 B14R2.11690 C=Cc1cccc2c1N(C(=O)C2)C 271570a_100011290941_100010870571 [0,0,1,1,0,0|1,0,1]=4 764 B14R2.11690 C=Cc1cccc2c1n(c(=O)[nH]2)C 271570a_100011290941_100010994120 [0,0,1,1,0,0|2,0,0]=4 765 B14R2.25733 CC(=O)n1cc(c2c1cccc2)O 271570a_203496583355_100010365038 [0,0,1,1,0,0|0,0,2]=4 766 B14R2.98 CCc1ccccc1c2ccco2 271570a_100000750936_100011215823 [0,0,1,1,0,0|2,0,0]=4 767 B14R2.98 CCc1ccccc1c2ccco2 271570a_100011216252_100009814098 [0,0,1,1,0,0|2,0,0]=4 768 B14R2.98 CNc1ccccc1c2cc[nH]c2 271570a_100000102155_100020606079 [0,0,1,1,0,0|2,0,0]=4 769 B14R2.98 CNc1ccccc1c2cc[nH]n2 271570a_100000062414_100020606079 [0,0,1,1,0,0|2,0,0]=4 770 B14R2.98 CNc1ccccc1c2ccco2 271570a_100000750936_100020606079 [0,0,1,1,0,0|1,0,0]=3 771 B14R2.98 CNc1ccccc1c2ccco2 34a_200020605208_200000210301 [0,0,1,1,0,0|1,0,0]=3 772 B14R2.98 CNc1ccccc1c2cccs2 271570a_100000742291_100020606079 [0,0,1,1,0,0|1,1,0]=4 773 B14R2.98 CNc1ccccc1c2ccoc2 271570a_100011218838_100020606079 [0,0,1,1,0,0|1,0,1]=4 774 B14R2.98 CNc1ccccc1c2ccsc2 271570a_100011934443_100020606079 [0,0,1,1,0,0|1,1,0]=4 775 B14R2.98 CNc1cccnc1c2ccco2 271570a_100000750936_200011806188 [0,0,1,1,0,0|2,0,0]=4 776 B14R2.98 CNc1ccncc1c2ccco2 271570a_100000750936_100010069531 [0,0,1,1,0,0|2,0,0]=4 777 B14R2.98 CNc1ncccc1c2ccco2 271570a_100000750936_100000700899 [0,0,1,1,0,0|2,0,0]=4 778 B14R2.98 COc1ccccc1c2ccco2 271570a_100000750936_100000174000 [0,0,1,1,0,0|2,0,0]=4 779 B14R2.98 COc1ccccc1c2ccco2 271570a_100000756652_100009814098 [0,0,1,1,0,0|2,0,0]=4 780 B14R2.98 COc1ccccc1c2ccno2 34a_100000031527_200000210301 [0,0,1,1,0,0|2,0,0]=4 781 B14R2.98 CSc1ccccc1c2ccco2 271570a_100000750936_100011217816 [0,0,1,1,0,0|2,0,0]=4 782 B14R2.98 CSc1ccccc1c2ccco2 271570a_100011218165_100009814098 [0,0,1,1,0,0|2,0,0]=4 783 B14R2.98 CSc1ccccc1c2ccno2 62a_100011218344_200000210301 [0,0,1,1,0,0|2,0,0]=4 784 B14R2.98 CSc1ccccc1c2ccno2 62a_200000210301_100011218344 [0,0,1,1,0,0|2,0,0]=4 785 B14R2.98 NNc1ccccc1c2ccco2 271570a_100000750936_100000241748 [0,0,1,1,0,0|2,0,0]=4 786 B14R2.98 [13CH3]Nc1ccccc1c2ccco2 34a_200020605208_200025704644 [0,0,1,1,0,0|1,0,0]=3 787 B14R2.98 [13CH3]Oc1ccccc1c2ccno2 34a_100000031527_200025704644 [0,0,1,1,0,0|2,0,0]=4 788 B14R2.98 [13CH3]Sc1ccccc1c2ccno2 62a_100011218344_200025704644 [0,0,1,1,0,0|2,0,0]=4 789 B14R2.98 [13CH3]Sc1ccccc1c2ccno2 62a_200025704644_100011218344 [0,0,1,1,0,0|2,0,0]=4 790 B14R2.510 CC=Cc1nn(c2c1cccc2)C 271570a_100016259895_100009817141 [0,0,1,1,0,0|2,0,0]=4 791 B14R2.11635 CCc1cccc2c1c(ccc2)O 271570a_203496583355_202517441601 [0,0,1,1,0,0|2,0,0]=4 792 B14R2.11635 CNc1cccc2c1c(ccc2)Br 34a_100010002837_200000210301 [0,0,1,1,0,0|2,0,0]=4 793 B14R2.11635 CNc1cccc2c1c(ccc2)C 34a_100009841044_200000210301 [0,0,1,1,0,0|2,0,0]=4 794 B14R2.11635 CNc1cccc2c1c(ccc2)C 7a_100009841044_200000210301 [0,0,1,1,0,0|2,0,0]=4 795 B14R2.11635 CNc1cccc2c1c(ccc2)Cl 34a_100009857565_200000210301 [0,0,1,1,0,0|2,0,0]=4 796 B14R2.11635 CNc1cccc2c1c(ccc2)F 34a_100009878580_200000210301 [0,0,1,1,0,0|2,0,0]=4 797 B14R2.11635 CNc1cccc2c1c(ccc2)F 7a_100009878580_200000210301 [0,0,1,1,0,0|2,0,0]=4 798 B14R2.11635 CNc1cccc2c1c(ccn2)Cl 34a_100010263589_200000210301 [0,0,1,1,0,0|2,0,0]=4 799 B14R2.11635 COc1cccc2c1c(ccc2)O 271570a_203496583355_100010152499 [0,0,1,1,0,0|2,0,0]=4 800 B14R2.11635 COc1cccc2c1c(ccn2)O 271570a_203496583355_100010204250 [0,0,1,1,0,0|2,0,0]=4 801 B14R2.11635 CSc1cccc2c1c(ccc2)O 62a_200000210301_100010089961 [0,0,1,1,0,0|2,0,0]=4 802 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 34a_100009841044_200025704644 [0,0,1,1,0,0|2,0,0]=4 803 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 7a_100009841044_200025704644 [0,0,1,1,0,0|2,0,0]=4 804 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Br 34a_100010002837_200025704644 [0,0,1,1,0,0|2,0,0]=4 805 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Cl 34a_100009857565_200025704644 [0,0,1,1,0,0|2,0,0]=4 806 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 34a_100009878580_200025704644 [0,0,1,1,0,0|2,0,0]=4 807 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 7a_100009878580_200025704644 [0,0,1,1,0,0|2,0,0]=4 808 B14R2.11635 [13CH3]Nc1cccc2c1c(ccn2)Cl 34a_100010263589_200025704644 [0,0,1,1,0,0|2,0,0]=4 809 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)O 62a_200025704644_100010089961 [0,0,1,1,0,0|2,0,0]=4 810 B14R2.24350 C=C(C)c1cccc2c1n(cc2)C 271570a_100000694244_100009817156 [0,0,1,1,0,0|2,0,0]=4 811 B14R2.24350 C=C(C)c1cccc2c1n(cn2)C 271570a_100000694244_100010749505 [0,0,1,1,0,0|2,0,0]=4 812 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [1,0,0,0,1,0|1,0,1]=4 813 B12R2.221 Cc1ccc(c2c1[nH]cc2)O 271570a_203496583355_100009820812 [1,0,0,0,1,0|2,0,0]=4 814 B12R2.221 Cc1ccc(c2c1cc[nH]2)O 271570a_203496583355_100010219157 [1,0,0,0,1,0|2,0,0]=4 815 B12R2.221 Cc1ccc(c2c1cco2)O 271570a_203496583355_100010253976 [1,0,0,0,1,0|2,0,0]=4 816 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_100000693194_100000185807 [0,0,1,0,0,1|0,0,2]=4 817 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_106832991635_100000182045 [0,0,1,0,0,1|0,0,2]=4 818 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 1626a_100102657272_100000182045 [0,0,1,0,0,1|0,0,2]=4 819 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100000693194_100000185807 [0,0,1,0,0,1|0,0,2]=4 820 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100102657272_100000182045 [0,0,1,0,0,1|0,0,2]=4 821 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100000693194_100000185807 [0,0,1,0,0,1|0,0,2]=4 822 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100102657272_100000182045 [0,0,1,0,0,1|0,0,2]=4 823 B14R1.163 CNC(=O)CSC(=S)c1ccccc1 1626a_100102657272_100000043459 [0,0,1,0,0,1|0,1,1]=4 824 B14R1.163 CNC(=O)CSC(=S)c1ccccc1 240690a_100102657272_100000043459 [0,0,1,0,0,1|0,1,1]=4 825 B14R1.163 CNC(=O)CSC(=S)c1ccccc1 527a_100102657272_100000043459 [0,0,1,0,0,1|0,1,1]=4 826 B14R1.163 CNC(=O)NCC(O)c1ccccc1 2708a_100102657272_100000210709 [0,0,1,0,0,1|0,0,2]=4 827 B14R1.163 CNC(=O)NCC(O)c1ccccc1 273464a_100000210709_100102657272 [0,0,1,0,0,1|0,0,2]=4 828 B14R1.163 CNC(=O)NCC(O)c1ccccc1 273464a_100102657272_100000210709 [0,0,1,0,0,1|0,0,2]=4 829 B14R1.163 CNC(=O)NCC(O)c1ccccc1 512a_106832991638_100000210709 [0,0,1,0,0,1|0,0,2]=4 830 B14R1.163 CNC(=O)NNC(=O)c1ccccc1 273464a_100102657272_100000184135 [0,0,1,0,0,1|1,0,1]=4 831 B14R1.163 CNC(=O)NNC(=O)c1ccccc1 512a_100000184135_100102657272 [0,0,1,0,0,1|1,0,1]=4 832 B14R1.743 CNC(=O)CC(=O)Oc1ccccc1 240690a_100102657272_200000075362 [0,0,1,0,0,1|0,0,2]=4 833 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210193 [0,0,1,0,0,1|1,0,1]=4 834 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210193 [0,0,1,0,0,1|1,0,1]=4 835 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210193 [0,0,1,0,0,1|1,0,1]=4 836 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210193 [0,0,1,0,0,1|1,0,1]=4 837 B14R1.60 CC(Cc1ccccc1)C(=O)C=CBr 1458a_100016273825_200011218536 [0,0,1,0,0,1|2,0,0]=4 838 B14R1.60 CC(Cc1ccccc1)C(=O)C=CCl 1458a_200016279998_200011218536 [0,0,1,0,0,1|2,0,0]=4 839 B14R1.60 CC(Cc1ccccc1)C(=O)C=CI 1458a_100016256311_200011218536 [0,0,1,0,0,1|2,0,0]=4 840 B14R1.60 CC=CC(=O)C(C)Cc1ccccc1 1458a_100000210699_200011218536 [0,0,1,0,0,1|2,0,0]=4 841 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210699 [0,0,1,0,0,1|1,0,0]=3 842 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210699 [0,0,1,0,0,1|1,0,0]=3 843 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210699 [0,0,1,0,0,1|1,0,0]=3 844 B14R1.60 CC=CC(=O)N(C)Cc1ccccn1 11a_100000207498_100000210699 [0,0,1,0,0,1|2,0,0]=4 845 B14R1.60 CC=CC(=O)N(C)Cc1ccccn1 240690a_100000207498_100000210699 [0,0,1,0,0,1|2,0,0]=4 846 B14R1.60 CC=CC(=O)N(C)Cc1cccnc1 11a_100000184577_100000210699 [0,0,1,0,0,1|2,0,0]=4 847 B14R1.60 CC=CC(=O)N(C)Cc1cccnc1 240690a_100000184577_100000210699 [0,0,1,0,0,1|2,0,0]=4 848 B14R1.60 CC=CC(=O)N(C)Cc1ccncc1 11a_100000187231_100000210699 [0,0,1,0,0,1|2,0,0]=4 849 B14R1.60 CC=CC(=O)N(C)Cc1ccncc1 240690a_100000187231_100000210699 [0,0,1,0,0,1|2,0,0]=4 850 B14R1.60 CN(Cc1ccccc1)C(=O)C=CBr 1626a_100000186898_100016273825 [0,0,1,0,0,1|1,0,0]=3 851 B14R1.60 CN(Cc1ccccc1)C(=O)C=CBr 240690a_100000186898_100016273825 [0,0,1,0,0,1|1,0,0]=3 852 B14R1.60 CN(Cc1ccccc1)C(=O)C=CCl 11a_100000186898_200016279998 [0,0,1,0,0,1|1,0,0]=3 853 B14R1.60 CN(Cc1ccccc1)C(=O)C=CCl 1626a_100000186898_200016279998 [0,0,1,0,0,1|1,0,0]=3 854 B14R1.60 CN(Cc1ccccc1)C(=O)C=CCl 240690a_100000186898_200016279998 [0,0,1,0,0,1|1,0,0]=3 855 B14R1.60 CN(Cc1ccccc1)C(=O)C=CI 1626a_100000186898_100016256311 [0,0,1,0,0,1|1,0,0]=3 856 B14R1.60 CN(Cc1ccccc1)C(=O)CCO 240690a_100000186898_100011216618 [0,0,1,0,0,1|0,0,2]=4 857 B14R1.60 CN(Cc1ccccn1)C(=O)C=CBr 240690a_100000207498_100016273825 [0,0,1,0,0,1|2,0,0]=4 858 B14R1.60 CN(Cc1ccccn1)C(=O)C=CCl 11a_100000207498_200016279998 [0,0,1,0,0,1|2,0,0]=4 859 B14R1.60 CN(Cc1ccccn1)C(=O)C=CCl 240690a_100000207498_200016279998 [0,0,1,0,0,1|2,0,0]=4 860 B14R1.60 CN(Cc1cccnc1)C(=O)C=CBr 240690a_100000184577_100016273825 [0,0,1,0,0,1|2,0,0]=4 861 B14R1.60 CN(Cc1cccnc1)C(=O)C=CCl 11a_100000184577_200016279998 [0,0,1,0,0,1|2,0,0]=4 862 B14R1.60 CN(Cc1cccnc1)C(=O)C=CCl 240690a_100000184577_200016279998 [0,0,1,0,0,1|2,0,0]=4 863 B14R1.60 CN(Cc1ccncc1)C(=O)C=CBr 240690a_100000187231_100016273825 [0,0,1,0,0,1|2,0,0]=4 864 B14R1.60 CN(Cc1ccncc1)C(=O)C=CCl 11a_100000187231_200016279998 [0,0,1,0,0,1|2,0,0]=4 865 B14R1.60 CN(Cc1ccncc1)C(=O)C=CCl 240690a_100000187231_200016279998 [0,0,1,0,0,1|2,0,0]=4 866 B14R1.3135 CC(=O)N(C)Cc1ccccc1CO 240690a_100000044721_100015343762 [0,0,1,0,0,1|0,0,2]=4 867 B14R1.3135 CC(=O)N(C)Cc1ccccc1CO 527a_100000044721_100103153847 [0,0,1,0,0,1|0,0,2]=4