0 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.7724 Cn1cc(c2ccccc2c1=O)O 271570a_203496583355_100000239302 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.7724 Cn1cc(c2ccncc2c1=O)O 271570a_203496583355_100054690642 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.7724 Oc1cc(c2cccnc2c1O)Cl 271570a_203496583355_100000211503 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.7724 Oc1cc(c2ncccc2c1F)F 271570a_203496583355_200009817093 [0,0,0,0,0,0|3,0,0]=3 5 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [1,0,0,0,0,0|1,0,0]=2 6 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [1,0,0,0,0,0|2,0,0]=3 8 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [1,0,0,0,0,0|1,0,1]=3 10 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [1,0,0,0,0,0|1,0,0]=2 13 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [1,0,0,0,0,0|2,0,0]=3 14 B13R2.32 Nc1c(ccc2c1ccnc2)O 271570a_203496583355_100010191621 [1,0,0,0,0,0|2,0,0]=3 15 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [1,0,0,0,0,0|2,0,0]=3 16 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [1,0,0,0,0,0|2,0,0]=3 17 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [1,0,0,0,0,0|1,0,1]=3 18 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [1,0,0,0,0,0|1,0,0]=2 23 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [1,0,0,0,0,0|1,0,0]=2 24 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [1,0,0,0,0,0|1,0,1]=3 25 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [1,0,0,0,0,0|1,0,0]=2 29 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [1,0,0,0,0,0|1,0,0]=2 30 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [1,0,0,0,0,0|0,0,1]=2 31 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [1,0,0,0,0,0|0,0,1]=2 32 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [1,0,0,0,0,0|2,0,0]=3 33 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [1,0,0,0,0,0|1,0,1]=3 34 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [1,0,0,0,0,0|1,0,1]=3 35 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [1,0,0,0,0,0|1,0,1]=3 36 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.32 Oc1nnc2ccccc2c1O 271570a_203496583355_100000688347 [1,0,0,0,0,0|2,0,1]=4 38 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [1,0,0,0,0,0|2,0,1]=4 39 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [1,0,0,0,0,0|2,0,1]=4 40 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [1,0,0,0,0,0|2,0,0]=3 41 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [1,0,0,0,0,0|3,0,0]=4 42 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [1,0,0,0,0,0|2,0,0]=3 43 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [1,0,0,0,0,0|2,0,1]=4 44 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [1,0,0,0,0,0|1,0,1]=3 46 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [1,0,0,0,0,0|1,0,0]=2 47 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [1,0,0,0,0,0|2,0,0]=3 48 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [1,0,0,0,0,0|2,0,0]=3 49 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [1,0,0,0,0,0|2,0,0]=3 50 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [1,0,0,0,0,0|2,0,1]=4 51 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [1,0,0,0,0,0|2,0,0]=3 52 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [1,0,0,0,0,0|1,0,0]=2 53 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [1,0,0,0,0,0|1,0,2]=4 54 B13R2.328 O=c1cc(nc2n1cccc2)O 271570a_203496583355_100000707704 [1,0,0,0,0,0|2,0,0]=3 55 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [1,0,0,0,0,0|0,0,1]=2 56 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [1,0,0,0,0,0|0,0,1]=2 57 B13R2.328 Oc1cc(c2cnccc2c1)F 271570a_203496583355_100011068762 [1,0,0,0,0,0|2,0,0]=3 58 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [1,0,0,0,0,0|1,0,1]=3 59 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [1,0,0,0,0,0|2,0,0]=3 60 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [1,0,0,0,0,0|2,0,0]=3 61 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [1,0,0,0,0,0|1,0,1]=3 62 B13R2.328 Oc1cc(c2nccnc2c1)F 271570a_203496583355_100010079260 [1,0,0,0,0,0|3,0,0]=4 63 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [1,0,0,0,0,0|2,0,1]=4 64 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [1,0,0,0,0,0|2,0,1]=4 65 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [1,0,0,0,0,0|1,0,2]=4 66 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [1,0,0,0,0,0|1,0,1]=3 67 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [1,0,0,0,0,0|1,0,1]=3 68 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [1,0,0,0,0,0|2,0,1]=4 69 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [1,0,0,0,0,0|2,0,1]=4 70 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [1,0,0,0,0,0|2,0,1]=4 71 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [1,0,0,0,0,0|1,0,1]=3 72 B13R2.371 Nc1ccc(c2c1cccn2)O 271570a_203496583355_100012360041 [1,0,0,0,0,0|2,0,1]=4 73 B13R2.371 Nc1ccc(c2c1ccnc2)O 271570a_203496583355_200012344021 [1,0,0,0,0,0|2,0,1]=4 74 B13R2.371 Nc1ccc(c2c1cncc2)O 271570a_203496583355_100011218454 [1,0,0,0,0,0|2,0,1]=4 75 B13R2.371 Nc1ccc(c2c1nccc2)O 271570a_203496583355_100000726955 [1,0,0,0,0,0|2,0,1]=4 76 B13R2.371 Nc1cnc(c2c1cccc2)O 271570a_203496583355_200009868590 [1,0,0,0,0,0|2,0,1]=4 77 B13R2.371 Nc1ncc(c2c1cccc2)O 271570a_203496583355_100010158575 [1,0,0,0,0,0|2,0,1]=4 78 B13R2.371 O=c1[nH]cc(c2c1cncc2)O 271570a_203496583355_100010090797 [1,0,0,0,0,0|2,0,1]=4 79 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [1,0,0,0,0,0|2,0,1]=4 80 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [1,0,0,0,0,0|1,0,1]=3 81 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [1,0,0,0,0,0|1,0,1]=3 82 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [1,0,0,0,0,0|0,0,2]=3 83 B13R2.371 Oc1ccc(c2c1cccn2)F 271570a_203496583355_100010245834 [1,0,0,0,0,0|2,0,1]=4 84 B13R2.371 Oc1ccc(c2c1cccn2)O 271570a_203496583355_100011934063 [1,0,0,0,0,0|1,0,2]=4 85 B13R2.371 Oc1ccc(c2c1ccnc2)F 271570a_203496583355_100000698020 [1,0,0,0,0,0|2,0,1]=4 86 B13R2.371 Oc1ccc(c2c1cncc2)F 271570a_203496583355_100010244717 [1,0,0,0,0,0|2,0,1]=4 87 B13R2.371 Oc1ccc(c2c1nccc2)F 271570a_203496583355_100010214461 [1,0,0,0,0,0|2,0,1]=4 88 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100000067196 [1,0,0,0,0,0|1,0,2]=4 89 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100009816523 [1,0,0,0,0,0|1,0,2]=4 90 B13R2.371 [O-][n+]1ccc(c2c1cccc2)O 271570a_203496583355_100020656173 [1,0,0,0,0,0|1,0,2]=4 91 B15R2.6124 CNc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200000210301 [0,1,0,0,0,0|3,0,0]=4 92 B15R2.6124 CNc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200000210301 [0,1,0,0,0,0|3,0,0]=4 93 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200000210301 [0,1,0,0,0,0|2,0,1]=4 94 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200000210301 [0,1,0,0,0,0|2,0,1]=4 95 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200025704644 [0,1,0,0,0,0|3,0,0]=4 96 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200025704644 [0,1,0,0,0,0|3,0,0]=4 97 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200025704644 [0,1,0,0,0,0|2,0,1]=4 98 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200025704644 [0,1,0,0,0,0|2,0,1]=4 99 B15R2.9032 Cc1c(c(=O)n(c2c1cccc2)C)O 271570a_203496583355_100010739255 [0,1,0,0,0,0|3,0,0]=4 100 B15R2.19973 COc1cc(c2ncccc2c1F)O 271570a_203496583355_100010742067 [0,1,0,0,0,0|2,0,1]=4 101 B15R2.19973 O=Cc1cc(c2ccccc2c1F)O 271570a_203496583355_100010235050 [0,1,0,0,0,0|1,0,2]=4 102 B15R2.21211 C=Cc1cn(c(=O)c2c1cccc2)C 271570a_100011290941_100000239302 [0,1,0,0,0,0|3,0,0]=4 103 B15R2.21211 CSc1cn(c(=O)c2c1cccc2)C 62a_100000239302_200000210301 [0,1,0,0,0,0|2,1,0]=4 104 B15R2.21211 CSc1cn(c(=O)c2c1cccc2)C 62a_200000210301_100000239302 [0,1,0,0,0,0|2,1,0]=4 105 B15R2.21211 Cn1cc(c2ccccc2c1=O)S[13CH3] 62a_100000239302_200025704644 [0,1,0,0,0,0|2,1,0]=4 106 B15R2.21211 Cn1cc(c2ccccc2c1=O)S[13CH3] 62a_200025704644_100000239302 [0,1,0,0,0,0|2,1,0]=4 107 B13R1.11 C=CC(=O)CC(=O)c1ccccc1 1458a_100000185746_100000211460 [0,0,1,0,0,0|1,0,2]=4 108 B13R1.89 CC(=C(C)c1ccccc1C=O)C 271570a_200000049429_100000211189 [0,0,1,0,0,0|2,0,1]=4 109 B13R1.464 C=CCC(=O)c1ccccc1C=C 1458a_100011830265_100000210623 [0,0,1,0,0,0|2,0,1]=4 110 B13R1.464 C=CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210623 [0,0,1,0,0,0|2,0,1]=4 111 B13R1.464 C=Cc1ccccc1C(=O)CCO 1458a_100011830265_100000211926 [0,0,1,0,0,0|1,0,2]=4 112 B13R1.464 O=Ic1ccccc1C(=O)CCO 1458a_100000032414_100000211926 [0,0,1,0,0,0|1,0,2]=4 113 B13R1.547 C=C(C)c1ccccc1C(=O)NC 271570a_100000694244_100000155073 [0,0,1,0,0,0|3,0,0]=4 114 B13R1.547 C=C(C)c1ccccc1C(=O)NN 271570a_100000694244_100000190081 [0,0,1,0,0,0|3,0,0]=4 115 B13R1.547 C=C(C)c1ccccc1C(=O)OC 271570a_100000694244_100000148710 [0,0,1,0,0,0|3,0,0]=4 116 B13R1.547 COC(=O)c1ccccc1C(=O)C 1458a_100011215673_200000210301 [0,0,1,0,0,0|2,0,1]=4 117 B13R1.547 COC(=O)c1ccccc1C(=O)[13CH3] 1458a_100011215673_200025704644 [0,0,1,0,0,0|2,0,1]=4 118 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [1,0,1,0,0,0|1,0,1]=4 119 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [1,0,1,0,0,0|1,0,1]=4 120 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [1,0,1,0,0,0|1,0,1]=4 121 B12R1.107 C=C(F)CC(=O)c1ccccc1 1458a_100000185807_100009893438 [1,0,1,0,0,0|1,0,1]=4 122 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [1,0,1,0,0,0|2,0,0]=4 123 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [1,0,1,0,0,0|2,0,0]=4 124 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,0,1,0,0,0|1,0,1]=4 125 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [1,0,1,0,0,0|1,0,1]=4 126 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [1,0,1,0,0,0|0,0,2]=4 127 B12R1.75 CC(=Cc1ccccc1C=O)C 271570a_100102525489_100000211189 [1,0,1,0,0,0|1,0,1]=4 128 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [1,0,1,0,0,0|1,0,1]=4 129 B12R1.77 C=Cc1ccccc1C(=O)CF 1458a_100011830265_100015361967 [1,0,1,0,0,0|1,0,1]=4 130 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [1,0,1,0,0,0|2,0,0]=4 131 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [1,0,1,0,0,0|2,0,0]=4 132 B12R1.77 C=Cc1ccccc1C(=O)NN 271570a_100011290941_100000190081 [1,0,1,0,0,0|2,0,0]=4 133 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [1,0,1,0,0,0|2,0,0]=4 134 B12R1.261 C=C(C)c1ccccc1C(=O)C 271570a_100000694244_100000751169 [1,0,1,0,0,0|1,0,1]=4 135 B12R1.261 C=C(C)c1ccccc1C(=O)N 271570a_100000694244_100000162227 [1,0,1,0,0,0|2,0,0]=4 136 B12R1.283 CC=Cc1ccccc1C(=O)C 271570a_100016259895_100000751169 [1,0,1,0,0,0|1,0,1]=4 137 B12R1.283 CC=Cc1ccccc1C(=O)N 271570a_100016259895_100000162227 [1,0,1,0,0,0|2,0,0]=4 138 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [2,0,0,0,0,0|1,0,0]=3 139 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [2,0,0,0,0,0|0,0,0]=2 140 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [2,0,0,0,0,0|1,0,0]=3 141 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [2,0,0,0,0,0|1,0,0]=3 142 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [2,0,0,0,0,0|2,0,0]=4 143 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [2,0,0,0,0,0|1,0,0]=3 144 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [2,0,0,0,0,0|2,0,0]=4 145 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [2,0,0,0,0,0|1,0,0]=3 146 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [2,0,0,0,0,0|2,0,0]=4 147 B12R2.24 Oc1ccc2cnncc2c1 271570a_203496583355_100010198781 [2,0,0,0,0,0|2,0,0]=4 148 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [2,0,0,0,0,0|1,0,0]=3 149 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [2,0,0,0,0,0|2,0,0]=4 150 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [2,0,0,0,0,0|2,0,0]=4 151 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [2,0,0,0,0,0|2,0,0]=4 152 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [2,0,0,0,0,0|2,0,0]=4 153 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [2,0,0,0,0,0|1,0,0]=3 154 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [2,0,0,0,0,0|2,0,0]=4 155 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [2,0,0,0,0,0|2,0,0]=4 156 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [2,0,0,0,0,0|2,0,0]=4 157 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [2,0,0,0,0,0|0,0,1]=3 158 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [2,0,0,0,0,0|1,0,1]=4 159 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [2,0,0,0,0,0|1,0,1]=4 160 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [2,0,0,0,0,0|1,0,1]=4 161 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [2,0,0,0,0,0|1,0,1]=4 162 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [2,0,0,0,0,0|1,0,1]=4 163 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [2,0,0,0,0,0|1,0,1]=4 164 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [2,0,0,0,0,0|1,0,1]=4 165 B14R1.415 CC(=O)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100011261029 [0,1,1,0,0,0|0,0,2]=4 166 B14R1.415 CC(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200000210301 [0,1,1,0,0,0|1,0,1]=4 167 B14R1.415 [13CH3]C(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200025704644 [0,1,1,0,0,0|1,0,1]=4 168 B14R1.95 C=Cc1ccccc1C(=O)C(=O)OC 271570a_100011290941_200010133017 [0,1,1,0,0,0|2,0,0]=4 169 B14R1.939 C/C=C/CC(=O)c1ccccc1I=O 1458a_100000032414_100102629194 [0,1,1,0,0,0|2,0,0]=4 170 B14R1.939 C=Cc1ccccc1C(=O)C/C=C/C 1458a_100011830265_100102629194 [0,1,1,0,0,0|2,0,0]=4 171 B14R1.939 C=Cc1ccccc1C(=O)CC=CC 1458a_100011830265_100000070051 [0,1,1,0,0,0|2,0,0]=4 172 B14R1.939 CC=CCC(=O)c1ccccc1I=O 1458a_100000032414_100000070051 [0,1,1,0,0,0|2,0,0]=4 173 B14R2.92 C=Cc1c[nH]c2ccccc2c1=O 271570a_100011290941_100012339567 [1,1,0,0,0,0|2,0,0]=4 174 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [1,1,0,0,0,0|2,0,0]=4 175 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [1,1,0,0,0,0|2,0,0]=4 176 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [1,1,0,0,0,0|2,0,0]=4 177 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [1,1,0,0,0,0|2,0,0]=4 178 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [1,1,0,0,0,0|1,0,1]=4 179 B14R2.92 C=Cc1coc2ccccc2c1=O 271570a_100011290941_100009813851 [1,1,0,0,0,0|2,0,0]=4 180 B14R2.92 CNc1ccc2ccccc2c1Br 34a_100000705303_200000210301 [1,1,0,0,0,0|2,0,0]=4 181 B14R2.92 CNc1ccc2ccccc2c1Cl 34a_100000075557_200000210301 [1,1,0,0,0,0|2,0,0]=4 182 B14R2.92 CNc1ccc2ccccc2c1O 34a_100000007060_200000210301 [1,1,0,0,0,0|1,0,1]=4 183 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [1,1,0,0,0,0|1,0,0]=3 184 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [1,1,0,0,0,0|1,0,0]=3 185 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [1,1,0,0,0,0|1,0,0]=3 186 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [1,1,0,0,0,0|1,0,0]=3 187 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [1,1,0,0,0,0|1,0,0]=3 188 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [1,1,0,0,0,0|1,0,0]=3 189 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [1,1,0,0,0,0|1,0,0]=3 190 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [1,1,0,0,0,0|1,0,0]=3 191 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [1,1,0,0,0,0|1,0,0]=3 192 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [1,1,0,0,0,0|1,0,0]=3 193 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [1,1,0,0,0,0|0,0,1]=3 194 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [1,1,0,0,0,0|2,0,0]=4 195 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [1,1,0,0,0,0|2,0,0]=4 196 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [1,1,0,0,0,0|1,0,1]=4 197 B14R2.92 COc1ccc2ccncc2c1Br 34a_200010115057_200000210301 [1,1,0,0,0,0|2,0,0]=4 198 B14R2.92 COc1ccc2ccncc2c1Br 7a_200010115057_200000210301 [1,1,0,0,0,0|2,0,0]=4 199 B14R2.92 COc1ccc2cnccc2c1Cl 34a_100009824633_200000210301 [1,1,0,0,0,0|2,0,0]=4 200 B14R2.92 COc1ccc2cnccc2c1Cl 7a_100009824633_200000210301 [1,1,0,0,0,0|2,0,0]=4 201 B14R2.92 CSc1c[nH]c2ccccc2c1=O 62a_200000210301_100012348052 [1,1,0,0,0,0|1,1,0]=4 202 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200000210301_200010089984 [1,1,0,0,0,0|1,1,0]=4 203 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200010089984_200000210301 [1,1,0,0,0,0|1,1,0]=4 204 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [1,1,0,0,0,0|1,1,0]=4 205 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [1,1,0,0,0,0|1,1,0]=4 206 B14R2.92 CSc1ccc2ccccc2c1F 62a_100009832041_200000210301 [1,1,0,0,0,0|1,1,0]=4 207 B14R2.92 CSc1ccc2ccccc2c1F 62a_200000210301_100009832041 [1,1,0,0,0,0|1,1,0]=4 208 B14R2.92 CSc1ccc2ccccc2c1N 62a_100009817101_200000210301 [1,1,0,0,0,0|1,1,0]=4 209 B14R2.92 CSc1ccc2ccccc2c1O 62a_200000210301_100009996032 [1,1,0,0,0,0|0,1,1]=4 210 B14R2.92 CSc1coc2ccccc2c1=O 62a_200000210301_100009813851 [1,1,0,0,0,0|1,1,0]=4 211 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [1,1,0,0,0,0|1,0,0]=3 212 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [1,1,0,0,0,0|1,0,0]=3 213 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [1,1,0,0,0,0|1,1,0]=4 214 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [1,1,0,0,0,0|1,1,0]=4 215 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [1,1,0,0,0,0|0,0,2]=4 216 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Br 34a_100000705303_200025704644 [1,1,0,0,0,0|2,0,0]=4 217 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Cl 34a_100000075557_200025704644 [1,1,0,0,0,0|2,0,0]=4 218 B14R2.92 [13CH3]Nc1ccc2ccccc2c1O 34a_100000007060_200025704644 [1,1,0,0,0,0|1,0,1]=4 219 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [1,1,0,0,0,0|1,0,0]=3 220 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [1,1,0,0,0,0|1,0,0]=3 221 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [1,1,0,0,0,0|1,0,0]=3 222 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [1,1,0,0,0,0|1,0,0]=3 223 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [1,1,0,0,0,0|1,0,0]=3 224 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [1,1,0,0,0,0|1,0,0]=3 225 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [1,1,0,0,0,0|1,0,0]=3 226 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [1,1,0,0,0,0|1,0,0]=3 227 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [1,1,0,0,0,0|2,0,0]=4 228 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [1,1,0,0,0,0|2,0,0]=4 229 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 34a_200010115057_200025704644 [1,1,0,0,0,0|2,0,0]=4 230 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 7a_200010115057_200025704644 [1,1,0,0,0,0|2,0,0]=4 231 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 34a_100009824633_200025704644 [1,1,0,0,0,0|2,0,0]=4 232 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 7a_100009824633_200025704644 [1,1,0,0,0,0|2,0,0]=4 233 B14R2.92 [13CH3]Sc1c[nH]c2ccccc2c1=O 62a_200025704644_100012348052 [1,1,0,0,0,0|1,1,0]=4 234 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200010089984_200025704644 [1,1,0,0,0,0|1,1,0]=4 235 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200025704644_200010089984 [1,1,0,0,0,0|1,1,0]=4 236 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_100009832041_200025704644 [1,1,0,0,0,0|1,1,0]=4 237 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_200025704644_100009832041 [1,1,0,0,0,0|1,1,0]=4 238 B14R2.92 [13CH3]Sc1ccc2ccccc2c1N 62a_100009817101_200025704644 [1,1,0,0,0,0|1,1,0]=4 239 B14R2.92 [13CH3]Sc1ccc2ccccc2c1O 62a_200025704644_100009996032 [1,1,0,0,0,0|0,1,1]=4 240 B14R2.92 [13CH3]Sc1coc2ccccc2c1=O 62a_200025704644_100009813851 [1,1,0,0,0,0|1,1,0]=4 241 B14R2.203 C=Cc1c(ccc2c1cccc2)Br 271570a_100011290941_100010090040 [1,1,0,0,0,0|2,0,0]=4 242 B14R2.203 C=Cc1c(ccc2c1cccc2)C 271570a_100011290941_100000759710 [1,1,0,0,0,0|2,0,0]=4 243 B14R2.203 C=Cc1c(ccc2c1cccc2)N 271570a_100011290941_100000705303 [1,1,0,0,0,0|2,0,0]=4 244 B14R2.203 C=Cc1c(ccc2c1cccc2)O 271570a_100011290941_100000183829 [1,1,0,0,0,0|1,0,0]=3 245 B14R2.203 C=Cc1c(ccc2c1cncc2)O 271570a_100011290941_200010115057 [1,1,0,0,0,0|2,0,0]=4 246 B14R2.203 C=Cc1c(ccc2c1nccc2)O 271570a_100011290941_100010173343 [1,1,0,0,0,0|2,0,0]=4 247 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [1,1,0,0,0,0|2,0,0]=4 248 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [1,1,0,0,0,0|2,0,0]=4 249 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [1,1,0,0,0,0|2,0,0]=4 250 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [1,1,0,0,0,0|1,0,0]=3 251 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [1,1,0,0,0,0|1,0,1]=4 252 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [1,1,0,0,0,0|1,0,1]=4 253 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [1,1,0,0,0,0|1,0,1]=4 254 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [1,1,0,0,0,0|1,0,1]=4 255 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [1,1,0,0,0,0|1,0,1]=4 256 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [1,1,0,0,0,0|0,0,1]=3 257 B14R2.203 COc1c(ccc2c1nccc2)O 271570a_203496583355_100010256708 [1,1,0,0,0,0|1,0,1]=4 258 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [1,1,0,0,0,0|1,1,0]=4 259 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [1,1,0,0,0,0|1,1,0]=4 260 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [1,1,0,0,0,0|1,1,0]=4 261 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [1,1,0,0,0,0|1,1,0]=4 262 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [1,1,0,0,0,0|1,1,0]=4 263 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [1,1,0,0,0,0|1,1,0]=4 264 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [1,1,0,0,0,0|0,1,0]=3 265 B14R2.203 CSc1c(ccc2c1cncc2)O 62a_200000210301_200010115057 [1,1,0,0,0,0|1,1,0]=4 266 B14R2.203 CSc1c(ccc2c1nccc2)O 62a_200000210301_100010173343 [1,1,0,0,0,0|1,1,0]=4 267 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [1,1,0,0,0,0|2,0,0]=4 268 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [1,1,0,0,0,0|1,0,1]=4 269 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [1,1,0,0,0,0|1,0,1]=4 270 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [1,1,0,0,0,0|1,1,0]=4 271 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [1,1,0,0,0,0|1,1,0]=4 272 B14R2.203 O=Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010090029 [1,1,0,0,0,0|0,0,0]=2 273 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [1,1,0,0,0,0|2,0,0]=4 274 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [1,1,0,0,0,0|2,0,0]=4 275 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [1,1,0,0,0,0|1,0,0]=3 276 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [1,1,0,0,0,0|1,0,1]=4 277 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [1,1,0,0,0,0|1,0,1]=4 278 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [1,1,0,0,0,0|1,0,1]=4 279 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [1,1,0,0,0,0|1,1,0]=4 280 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [1,1,0,0,0,0|1,1,0]=4 281 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [1,1,0,0,0,0|1,1,0]=4 282 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [1,1,0,0,0,0|1,1,0]=4 283 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [1,1,0,0,0,0|0,1,0]=3 284 B14R2.203 [13CH3]Sc1c(ccc2c1cncc2)O 62a_200025704644_200010115057 [1,1,0,0,0,0|1,1,0]=4 285 B14R2.203 [13CH3]Sc1c(ccc2c1nccc2)O 62a_200025704644_100010173343 [1,1,0,0,0,0|1,1,0]=4 286 B14R2.4513 Cc1ccc2occ(c(=O)c2c1)O 271570a_203496583355_200010005421 [1,1,0,0,0,0|1,0,0]=3 287 B14R2.4513 Cn1ccc2ccc(cc2c1=O)O 271570a_203496583355_100010371002 [1,1,0,0,0,0|2,0,0]=4 288 B14R2.4513 O=c1c(c[nH]c2c1cc(cc2)Br)O 271570a_203496583355_100012348040 [1,1,0,0,0,0|1,0,0]=3 289 B14R2.4513 O=c1c(coc2c1cc(cc2)Cl)O 271570a_203496583355_200010204847 [1,1,0,0,0,0|1,0,0]=3 290 B14R2.4513 O=c1c(coc2c1cc(cc2)F)O 271570a_203496583355_200009813772 [1,1,0,0,0,0|1,0,0]=3 291 B14R2.8038 O=c1c(c[nH]c2c1cccc2F)O 271570a_203496583355_100012351745 [1,1,0,0,0,0|1,0,0]=3 292 B14R2.8038 O=c1cc[nH]c2c1ccc(c2F)O 271570a_203496583355_100022010583 [1,1,0,0,0,0|2,0,0]=4 293 B14R2.8188 Cc1c(c(nc2c1cccc2)O)O 271570a_203496583355_100009820873 [1,1,0,0,0,0|2,0,0]=4 294 B14R2.8188 Oc1c(cc2ncccc2c1F)F 271570a_203496583355_100010163946 [1,1,0,0,0,0|2,0,0]=4 295 B14R2.28523 Cn1ccc2cccc(c2c1=O)O 271570a_203496583355_100010332868 [1,1,0,0,0,0|2,0,0]=4 296 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [1,1,0,0,0,0|1,0,1]=4 297 B14R2.29369 Cn1ccc2cc(ccc2c1=O)O 271570a_203496583355_100010246303 [1,1,0,0,0,0|2,0,0]=4 298 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [1,1,0,0,0,0|0,0,1]=3 299 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [1,1,0,0,0,0|1,0,0]=3 300 B14R2.1019 C=Cc1cc(=O)c2ccccc2[nH]1 271570a_100011290941_100000090176 [1,1,0,0,0,0|2,0,0]=4 301 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [1,1,0,0,0,0|2,0,0]=4 302 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [1,1,0,0,0,0|1,0,1]=4 303 B14R2.1019 CNc1cc(c2ccccc2c1)Br 34a_100010089974_200000210301 [1,1,0,0,0,0|2,0,0]=4 304 B14R2.1019 CNc1cc(c2ccccc2c1)Br 7a_100010089974_200000210301 [1,1,0,0,0,0|2,0,0]=4 305 B14R2.1019 COc1cc(=O)n2ccccc2n1 34a_100000751361_200000210301 [1,1,0,0,0,0|2,0,0]=4 306 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [1,1,0,0,0,0|1,0,0]=3 307 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [1,1,0,0,0,0|1,0,0]=3 308 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [1,1,0,0,0,0|0,0,1]=3 309 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [1,1,0,0,0,0|1,0,1]=4 310 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [1,1,0,0,0,0|1,0,1]=4 311 B14R2.1019 COc1cc(c2cnccc2c1)Br 34a_100011009069_200000210301 [1,1,0,0,0,0|2,0,0]=4 312 B14R2.1019 COc1cc(c2cnccc2c1)Br 7a_100011009069_200000210301 [1,1,0,0,0,0|2,0,0]=4 313 B14R2.1019 COc1cc(c2ncccc2c1)Cl 34a_100000097192_200000210301 [1,1,0,0,0,0|2,0,0]=4 314 B14R2.1019 COc1cc(c2ncccc2c1)Cl 7a_100000097192_200000210301 [1,1,0,0,0,0|2,0,0]=4 315 B14R2.1019 COc1cc(c2ncccc2c1)F 34a_100009888031_200000210301 [1,1,0,0,0,0|2,0,0]=4 316 B14R2.1019 COc1cc(c2ncccc2c1)F 7a_100009888031_200000210301 [1,1,0,0,0,0|2,0,0]=4 317 B14R2.1019 COc1cc(c2ncccc2c1)N 34a_100000083691_200000210301 [1,1,0,0,0,0|2,0,0]=4 318 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [1,1,0,0,0,0|1,0,1]=4 319 B14R2.1019 CSc1cc(=O)c2ccccc2[nH]1 62a_200000210301_100000090176 [1,1,0,0,0,0|1,1,0]=4 320 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_100010171453_200000210301 [1,1,0,0,0,0|1,1,0]=4 321 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_200000210301_100010171453 [1,1,0,0,0,0|1,1,0]=4 322 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [1,1,0,0,0,0|0,1,1]=4 323 B14R2.1019 CSc1cc2ccccc2c(=O)[nH]1 62a_200000210301_200015811170 [1,1,0,0,0,0|1,1,0]=4 324 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 34a_100010089974_200025704644 [1,1,0,0,0,0|2,0,0]=4 325 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 7a_100010089974_200025704644 [1,1,0,0,0,0|2,0,0]=4 326 B14R2.1019 [13CH3]Oc1cc(=O)n2ccccc2n1 34a_100000751361_200025704644 [1,1,0,0,0,0|2,0,0]=4 327 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [1,1,0,0,0,0|1,0,0]=3 328 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [1,1,0,0,0,0|1,0,0]=3 329 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 34a_100011009069_200025704644 [1,1,0,0,0,0|2,0,0]=4 330 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 7a_100011009069_200025704644 [1,1,0,0,0,0|2,0,0]=4 331 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 34a_100000097192_200025704644 [1,1,0,0,0,0|2,0,0]=4 332 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 7a_100000097192_200025704644 [1,1,0,0,0,0|2,0,0]=4 333 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 34a_100009888031_200025704644 [1,1,0,0,0,0|2,0,0]=4 334 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 7a_100009888031_200025704644 [1,1,0,0,0,0|2,0,0]=4 335 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)N 34a_100000083691_200025704644 [1,1,0,0,0,0|2,0,0]=4 336 B14R2.1019 [13CH3]Sc1cc(=O)c2ccccc2[nH]1 62a_200025704644_100000090176 [1,1,0,0,0,0|1,1,0]=4 337 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_100010171453_200025704644 [1,1,0,0,0,0|1,1,0]=4 338 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_200025704644_100010171453 [1,1,0,0,0,0|1,1,0]=4 339 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [1,1,0,0,0,0|0,1,1]=4 340 B14R2.1019 [13CH3]Sc1cc2ccccc2c(=O)[nH]1 62a_200025704644_200015811170 [1,1,0,0,0,0|1,1,0]=4 341 B14R2.1146 C=Cc1cc(cc2c1cccc2)N 271570a_100011290941_100010089974 [1,1,0,0,0,0|2,0,0]=4 342 B14R2.1146 C=Cc1cc(cc2c1cccc2)O 271570a_100011290941_100010001680 [1,1,0,0,0,0|1,0,0]=3 343 B14R2.1146 C=Cc1cc(cc2c1cncc2)O 271570a_100011290941_100011009069 [1,1,0,0,0,0|2,0,0]=4 344 B14R2.1146 CNc1cc(cc2c1cccc2)Br 34a_100010171453_200000210301 [1,1,0,0,0,0|2,0,0]=4 345 B14R2.1146 CNc1cc(cc2c1nccc2)O 34a_100000083691_200000210301 [1,1,0,0,0,0|2,0,0]=4 346 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [1,1,0,0,0,0|1,0,1]=4 347 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [1,1,0,0,0,0|1,0,1]=4 348 B14R2.1146 COc1cc(cc2c1cccn2)O 271570a_203496583355_100010248854 [1,1,0,0,0,0|1,0,1]=4 349 B14R2.1146 COc1cc(cc2c1nccc2)O 271570a_203496583355_100010248852 [1,1,0,0,0,0|1,0,1]=4 350 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [1,1,0,0,0,0|1,0,1]=4 351 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_100010089974_200000210301 [1,1,0,0,0,0|1,1,0]=4 352 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_200000210301_100010089974 [1,1,0,0,0,0|1,1,0]=4 353 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [1,1,0,0,0,0|0,1,0]=3 354 B14R2.1146 CSc1cc(cc2c1cncc2)O 62a_200000210301_100011009069 [1,1,0,0,0,0|1,1,0]=4 355 B14R2.1146 [13CH3]Nc1cc(cc2c1cccc2)Br 34a_100010171453_200025704644 [1,1,0,0,0,0|2,0,0]=4 356 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)O 34a_100000083691_200025704644 [1,1,0,0,0,0|2,0,0]=4 357 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [1,1,0,0,0,0|1,0,1]=4 358 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [1,1,0,0,0,0|1,0,1]=4 359 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_100010089974_200025704644 [1,1,0,0,0,0|1,1,0]=4 360 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_200025704644_100010089974 [1,1,0,0,0,0|1,1,0]=4 361 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [1,1,0,0,0,0|0,1,0]=3 362 B14R2.1146 [13CH3]Sc1cc(cc2c1cncc2)O 62a_200025704644_100011009069 [1,1,0,0,0,0|1,1,0]=4 363 B14R2.8045 Cc1cc(nc2c1cccc2C)O 271570a_203496583355_100000008058 [1,1,0,0,0,0|2,0,0]=4 364 B14R2.8045 O=c1cc[nH]c2c1cc(cc2F)O 271570a_203496583355_100000749450 [1,1,0,0,0,0|2,0,0]=4 365 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011333642 [1,1,0,0,0,0|2,0,0]=4 366 B14R2.8235 Cc1cc(nc2c1cc(cc2)F)O 271570a_203496583355_200000079853 [1,1,0,0,0,0|2,0,0]=4 367 B14R2.8235 O=c1cc(nc2n1cc(cc2)F)O 271570a_203496583355_100015492560 [1,1,0,0,0,0|2,0,0]=4 368 B14R2.8235 O=c1cc(nc2n1cc(cc2)O)O 271570a_203496583355_100016101194 [1,1,0,0,0,0|2,0,0]=4 369 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)F)O 271570a_203496583355_100012034177 [1,1,0,0,0,0|2,0,0]=4 370 B14R2.8235 Oc1cc(c2cc(ccc2c1)O)F 271570a_203496583355_100010201084 [1,1,0,0,0,0|1,0,0]=3 371 B14R2.29365 Cc1cc(nc2c1ccc(c2)N)O 271570a_203496583355_100000103534 [1,1,0,0,0,0|2,0,0]=4 372 B14R2.29365 Cc1cc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100010883700 [1,1,0,0,0,0|2,0,0]=4 373 B14R2.1131 C=Cc1ccc(c2c1cccc2)Br 271570a_100011290941_100012339872 [1,1,0,0,0,0|2,0,0]=4 374 B14R2.1131 C=Cc1ccc(c2c1cccc2)C 271570a_100011290941_100011215156 [1,1,0,0,0,0|2,0,0]=4 375 B14R2.1131 C=Cc1ccc(c2c1cccc2)F 271570a_100011290941_100011218216 [1,1,0,0,0,0|2,0,0]=4 376 B14R2.1131 C=Cc1ccc(c2c1cccc2)N 271570a_100011290941_100000766797 [1,1,0,0,0,0|2,0,0]=4 377 B14R2.1131 C=Cc1ccc(c2c1cccc2)O 271570a_100011290941_100000186334 [1,1,0,0,0,0|1,0,1]=4 378 B14R2.1131 CNc1ccc(c2c1cccc2)Br 34a_100000766797_200000210301 [1,1,0,0,0,0|2,0,0]=4 379 B14R2.1131 CNc1ccc(c2c1cccc2)Cl 34a_100011216319_200000210301 [1,1,0,0,0,0|2,0,0]=4 380 B14R2.1131 CNc1ccc(c2c1cccc2)F 34a_100011988692_200000210301 [1,1,0,0,0,0|2,0,0]=4 381 B14R2.1131 CNc1ccc(c2c1cccc2)O 34a_100000705857_200000210301 [1,1,0,0,0,0|1,0,1]=4 382 B14R2.1131 COc1ccc(c2c1cccc2)Br 34a_100000186334_200000210301 [1,1,0,0,0,0|1,0,1]=4 383 B14R2.1131 COc1ccc(c2c1cccc2)Br 7a_100000186334_200000210301 [1,1,0,0,0,0|1,0,1]=4 384 B14R2.1131 COc1ccc(c2c1cccc2)C 34a_100000074455_200000210301 [1,1,0,0,0,0|1,0,1]=4 385 B14R2.1131 COc1ccc(c2c1cccc2)C 7a_100000074455_200000210301 [1,1,0,0,0,0|1,0,1]=4 386 B14R2.1131 COc1ccc(c2c1cccc2)Cl 34a_100000211000_200000210301 [1,1,0,0,0,0|1,0,1]=4 387 B14R2.1131 COc1ccc(c2c1cccc2)Cl 7a_100000211000_200000210301 [1,1,0,0,0,0|1,0,1]=4 388 B14R2.1131 COc1ccc(c2c1cccc2)F 34a_100000100223_200000210301 [1,1,0,0,0,0|1,0,1]=4 389 B14R2.1131 COc1ccc(c2c1cccc2)F 7a_100000100223_200000210301 [1,1,0,0,0,0|1,0,1]=4 390 B14R2.1131 COc1ccc(c2c1cccc2)N 34a_100000705857_200000210301 [1,1,0,0,0,0|1,0,1]=4 391 B14R2.1131 COc1ccc(c2c1cccc2)N 7a_100000705857_200000210301 [1,1,0,0,0,0|1,0,1]=4 392 B14R2.1131 COc1ccc(c2c1cccc2)O 271570a_203496583355_100011256618 [1,1,0,0,0,0|0,0,2]=4 393 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_100012339872_200000210301 [1,1,0,0,0,0|1,1,0]=4 394 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_200000210301_100012339872 [1,1,0,0,0,0|1,1,0]=4 395 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_100011215156_200000210301 [1,1,0,0,0,0|1,1,0]=4 396 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_200000210301_100011215156 [1,1,0,0,0,0|1,1,0]=4 397 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_100011218216_200000210301 [1,1,0,0,0,0|1,1,0]=4 398 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_200000210301_100011218216 [1,1,0,0,0,0|1,1,0]=4 399 B14R2.1131 CSc1ccc(c2c1cccc2)N 62a_100000766797_200000210301 [1,1,0,0,0,0|1,1,0]=4 400 B14R2.1131 CSc1ccc(c2c1cccc2)O 62a_200000210301_100000186334 [1,1,0,0,0,0|0,1,1]=4 401 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 34a_100000074455_200025704644 [1,1,0,0,0,0|1,0,1]=4 402 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 7a_100000074455_200025704644 [1,1,0,0,0,0|1,0,1]=4 403 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_100011215156_200025704644 [1,1,0,0,0,0|1,1,0]=4 404 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_200025704644_100011215156 [1,1,0,0,0,0|1,1,0]=4 405 B14R2.1131 N#Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012344970 [1,1,0,0,0,0|1,0,1]=4 406 B14R2.1131 NCc1ccc(c2c1cccc2)O 271570a_203496583355_100016995114 [1,1,0,0,0,0|1,0,1]=4 407 B14R2.1131 O=Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012359940 [1,1,0,0,0,0|0,0,1]=3 408 B14R2.1131 O=Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694311 [1,1,0,0,0,0|1,0,1]=4 409 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Br 34a_100000766797_200025704644 [1,1,0,0,0,0|2,0,0]=4 410 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Cl 34a_100011216319_200025704644 [1,1,0,0,0,0|2,0,0]=4 411 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)F 34a_100011988692_200025704644 [1,1,0,0,0,0|2,0,0]=4 412 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)O 34a_100000705857_200025704644 [1,1,0,0,0,0|1,0,1]=4 413 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 34a_100000186334_200025704644 [1,1,0,0,0,0|1,0,1]=4 414 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 7a_100000186334_200025704644 [1,1,0,0,0,0|1,0,1]=4 415 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 34a_100000211000_200025704644 [1,1,0,0,0,0|1,0,1]=4 416 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 7a_100000211000_200025704644 [1,1,0,0,0,0|1,0,1]=4 417 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 34a_100000100223_200025704644 [1,1,0,0,0,0|1,0,1]=4 418 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 7a_100000100223_200025704644 [1,1,0,0,0,0|1,0,1]=4 419 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 34a_100000705857_200025704644 [1,1,0,0,0,0|1,0,1]=4 420 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 7a_100000705857_200025704644 [1,1,0,0,0,0|1,0,1]=4 421 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_100012339872_200025704644 [1,1,0,0,0,0|1,1,0]=4 422 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_200025704644_100012339872 [1,1,0,0,0,0|1,1,0]=4 423 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_100011218216_200025704644 [1,1,0,0,0,0|1,1,0]=4 424 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_200025704644_100011218216 [1,1,0,0,0,0|1,1,0]=4 425 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)N 62a_100000766797_200025704644 [1,1,0,0,0,0|1,1,0]=4 426 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)O 62a_200025704644_100000186334 [1,1,0,0,0,0|0,1,1]=4 427 B14R2.8751 O=c1[nH]cc(c2c1ccc(c2)F)O 271570a_203496583355_100010191626 [1,1,0,0,0,0|1,0,1]=4 428 B14R2.215 CNC1C(=O)c2ccccc2C1=O 2230a_106832991635_200009813996 [0,1,0,0,1,0|1,0,1]=4 429 B14R2.215 CSC1C(=O)c2ccccc2C1=O 62a_200000210301_200009813996 [0,1,0,0,1,0|0,1,1]=4 430 B14R2.215 CSC1C(=O)c2ccccc2C1=O 62a_200009813996_200000210301 [0,1,0,0,1,0|0,1,1]=4 431 B14R2.215 [13CH3]SC1C(=O)c2ccccc2C1=O 62a_200009813996_200025704644 [0,1,0,0,1,0|0,1,1]=4 432 B14R2.215 [13CH3]SC1C(=O)c2ccccc2C1=O 62a_200025704644_200009813996 [0,1,0,0,1,0|0,1,1]=4 433 B14R2.8716 CN1C(=O)c2ccc(cc2C1=O)O 271570a_203496583355_200009814873 [0,1,0,0,1,0|2,0,0]=4 434 B16R2.36854 CC1=CC(=O)c2c(cccc2C1=O)O[13CH3] 7a_100000032304_200025704644 [0,2,0,0,0,0|1,0,0]=3 435 B16R2.36854 COc1cccc2c1C(=O)C=C(C2=O)C 7a_100000032304_200000210301 [0,2,0,0,0,0|1,0,0]=3 436 B16R2.23331 OB(O)c1cc(c2ccccc2c1F)O 271570a_203496583355_100010199707 [0,2,0,0,0,0|1,0,1]=4 437 B14R2.8 O=Cc1c[nH]c(c1)c2ccccc2 271570a_100011218836_100009882863 [0,0,1,1,0,0|2,0,0]=4 438 B14R2.8 O=Cc1cc(co1)c2ccccc2 271570a_100000068347_100000210277 [0,0,1,1,0,0|1,0,0]=3 439 B14R2.8 O=Cc1cc(co1)c2ccccc2 271570a_100011218836_100000747035 [0,0,1,1,0,0|1,0,0]=3 440 B14R2.8 O=Cc1cc(co1)c2ccccn2 271570a_100000068347_100011216584 [0,0,1,1,0,0|2,0,0]=4 441 B14R2.8 O=Cc1cc(co1)c2ccccn2 271570a_100011264011_100000747035 [0,0,1,1,0,0|2,0,0]=4 442 B14R2.8 O=Cc1cc(co1)c2cccnc2 271570a_100000068347_100000752921 [0,0,1,1,0,0|2,0,0]=4 443 B14R2.8 O=Cc1cc(co1)c2cccnc2 271570a_100000757648_100000747035 [0,0,1,1,0,0|2,0,0]=4 444 B14R2.8 O=Cc1cc(co1)c2ccncc2 271570a_100000068347_100000035832 [0,0,1,1,0,0|2,0,0]=4 445 B14R2.8 O=Cc1cc(co1)c2ccncc2 271570a_100000752145_100000747035 [0,0,1,1,0,0|2,0,0]=4 446 B14R2.8 O=Cc1cc(cs1)c2ccccc2 271570a_100000067010_100000210277 [0,0,1,1,0,0|1,1,0]=4 447 B14R2.8 O=Cc1cc(cs1)c2ccccc2 271570a_100011218836_100000211722 [0,0,1,1,0,0|1,1,0]=4 448 B14R2.8 O=Cc1coc(c1)c2ccccc2 271570a_200000066965_100000210277 [0,0,1,1,0,0|1,0,1]=4 449 B14R2.8 O=Cc1csc(c1)c2ccccc2 271570a_100011218836_100000737087 [0,0,1,1,0,0|1,1,0]=4 450 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_100000693801_100000210277 [0,0,1,1,0,0|2,0,0]=4 451 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_100011218836_100000211634 [0,0,1,1,0,0|2,0,0]=4 452 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_203496583355_100009813342 [0,0,1,1,0,0|2,0,0]=4 453 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_100011218836_100000762945 [0,0,1,1,0,0|2,0,0]=4 454 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_203496583355_100010243831 [0,0,1,1,0,0|2,0,0]=4 455 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_100010248756_100000210277 [0,0,1,1,0,0|2,0,0]=4 456 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_100011218836_100000754920 [0,0,1,1,0,0|2,0,0]=4 457 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_203496583355_100010138719 [0,0,1,1,0,0|2,0,0]=4 458 B14R2.21 Oc1cnnc(c1)c2ccccc2 271570a_100011218836_200010734679 [0,0,1,1,0,0|2,0,0]=4 459 B14R2.24 Oc1ccccc1c2ccccc2 271570a_100000035170_100000210277 [0,0,1,1,0,0|2,0,0]=4 460 B14R2.24 Oc1ccccc1c2ccccc2 271570a_100011218836_100000739446 [0,0,1,1,0,0|2,0,0]=4 461 B14R2.24 Oc1ccccc1c2ccccc2 271570a_203496583355_100000033479 [0,0,1,1,0,0|2,0,0]=4 462 B14R2.24 Oc1cccnc1c2ccccc2 271570a_100011218836_100000034122 [0,0,1,1,0,0|2,0,0]=4 463 B14R2.24 Oc1cccnc1c2ccccc2 271570a_203496583355_100010138707 [0,0,1,1,0,0|2,0,0]=4 464 B14R2.114 C=C(c1ccccc1)c2ccco2 271570a_100000068269_100009814098 [0,0,1,1,0,0|2,0,0]=4 465 B14R2.98 C=Cc1ccccc1c2ccoc2 271570a_100000037480_100011215275 [0,0,1,1,0,0|2,0,0]=4 466 B14R2.98 O=Cc1ccccc1C2=CCOC2 271570a_100009872500_100000211189 [0,0,1,1,0,0|1,0,1]=4 467 B14R2.98 O=Cc1ccccc1c2cc[nH]c2 271570a_100000102155_100000211189 [0,0,1,1,0,0|2,0,0]=4 468 B14R2.98 O=Cc1ccccc1c2cc[nH]n2 271570a_100000062414_100000211189 [0,0,1,1,0,0|2,0,0]=4 469 B14R2.98 O=Cc1ccccc1c2cc[nH]n2 271570a_100000740022_100000062575 [0,0,1,1,0,0|2,0,0]=4 470 B14R2.98 O=Cc1ccccc1c2ccco2 271570a_100000740022_100009814098 [0,0,1,1,0,0|1,0,1]=4 471 B14R2.98 O=Cc1ccccc1c2ccco2 271570a_100000750936_100000211189 [0,0,1,1,0,0|1,0,1]=4 472 B14R2.98 O=Cc1ccccc1c2cccs2 271570a_100000740022_100011215356 [0,0,1,1,0,0|1,1,0]=4 473 B14R2.98 O=Cc1ccccc1c2cccs2 271570a_100000742291_100000211189 [0,0,1,1,0,0|1,1,0]=4 474 B14R2.98 O=Cc1ccccc1c2ccoc2 271570a_100000740022_100011215275 [0,0,1,1,0,0|1,0,0]=3 475 B14R2.98 O=Cc1ccccc1c2ccoc2 271570a_100011218838_100000211189 [0,0,1,1,0,0|1,0,0]=3 476 B14R2.98 O=Cc1ccccc1c2ccsc2 271570a_100000740022_100000738268 [0,0,1,1,0,0|1,1,0]=4 477 B14R2.98 O=Cc1ccccc1c2ccsc2 271570a_100011934443_100000211189 [0,0,1,1,0,0|1,1,0]=4 478 B14R2.98 O=Cc1ccccc1c2ccsn2 271570a_100000740022_100009818082 [0,0,1,1,0,0|1,1,0]=4 479 B14R2.98 O=Cc1ccccc1c2cnoc2 271570a_100000740022_100009815712 [0,0,1,1,0,0|2,0,0]=4 480 B14R2.98 O=Cc1cccnc1c2ccoc2 271570a_100011218838_100009816751 [0,0,1,1,0,0|2,0,0]=4 481 B14R2.98 O=Cc1ccncc1c2ccoc2 271570a_100011218838_100011934409 [0,0,1,1,0,0|2,0,0]=4 482 B14R2.98 O=Cc1cnccc1c2ccoc2 271570a_100011218838_100000050567 [0,0,1,1,0,0|2,0,0]=4 483 B14R2.98 O=Cc1ncccc1c2ccoc2 271570a_100011218838_100011934733 [0,0,1,1,0,0|2,0,0]=4 484 B14R2.11635 COc1cccc2c1c(=O)cco2 34a_100000040341_200000210301 [0,0,1,1,0,0|2,0,0]=4 485 B14R2.11635 COc1cccc2c1c(=O)cco2 7a_100000040341_200000210301 [0,0,1,1,0,0|2,0,0]=4 486 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 34a_100000040341_200025704644 [0,0,1,1,0,0|2,0,0]=4 487 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 7a_100000040341_200025704644 [0,0,1,1,0,0|2,0,0]=4 488 B14R2.24350 C=C(C)c1cccc2c1C(=O)CO2 271570a_100000694244_100010205902 [0,0,1,1,0,0|1,0,1]=4 489 B16R3.13490 Oc1cc2onnc2c3c1cccc3 271570a_203496583355_100121572884 [0,1,0,1,0,0|1,0,1]=4 490 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [1,0,0,0,1,0|2,0,0]=4 491 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [1,0,0,0,1,0|2,0,0]=4 492 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [1,0,0,0,1,0|2,0,0]=4 493 B12R2.82 O=c1c(c[nH]c2c1scc2)O 271570a_203496583355_100012569241 [1,0,0,0,1,0|2,0,0]=4 494 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [1,0,0,0,1,0|2,0,0]=4 495 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [1,0,0,0,1,0|2,0,0]=4 496 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [1,0,0,0,1,0|2,0,0]=4 497 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [1,0,0,0,1,0|2,0,0]=4 498 B12R2.246 Nc1cc(cc2c1cc[nH]2)O 271570a_203496583355_106744500199 [1,0,0,0,1,0|2,0,0]=4 499 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [1,0,0,0,1,0|2,0,0]=4 500 B12R2.246 Oc1cc(c2cc[nH]c2c1)Br 271570a_203496583355_100009814775 [1,0,0,0,1,0|2,0,0]=4 501 B12R2.246 Oc1cc(c2cc[nH]c2c1)F 271570a_203496583355_100010186028 [1,0,0,0,1,0|2,0,0]=4 502 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [1,0,0,0,1,0|2,0,0]=4 503 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [1,0,0,0,1,0|1,0,1]=4 504 B14R1.3135 C=C(C)C(=O)Cc1ccccc1C=O 1458a_100000185857_200009853537 [0,0,1,0,0,1|1,0,0]=3 505 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)Br 11a_100012022501_100009813364 [0,0,1,0,0,1|2,0,0]=4 506 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)Br 1626a_100012022501_100009813364 [0,0,1,0,0,1|2,0,0]=4 507 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)C 11a_100012022501_100000185857 [0,0,1,0,0,1|2,0,0]=4 508 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)C 1626a_100012022501_100000185857 [0,0,1,0,0,1|2,0,0]=4 509 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)C 22a_100012022501_100000185857 [0,0,1,0,0,1|2,0,0]=4 510 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)Cl 11a_100012022501_100000039160 [0,0,1,0,0,1|2,0,0]=4 511 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)Cl 1626a_100012022501_100000039160 [0,0,1,0,0,1|2,0,0]=4 512 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)Cl 22a_100012022501_100000039160 [0,0,1,0,0,1|2,0,0]=4 513 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)F 11a_100012022501_100000036797 [0,0,1,0,0,1|2,0,0]=4 514 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)F 1626a_100012022501_100000036797 [0,0,1,0,0,1|2,0,0]=4 515 B14R1.3135 C=Cc1ccccc1NC(=O)C(=C)F 22a_100012022501_100000036797 [0,0,1,0,0,1|2,0,0]=4 516 B14R1.3135 C[C@@H](O)C(=O)Cc1ccccc1C=O 1458a_100000717761_200009853537 [0,0,1,0,0,1|0,0,2]=4 517 B14R1.3135 C[C@H](O)C(=O)Cc1ccccc1C=O 1458a_217856618621_200009853537 [0,0,1,0,0,1|0,0,2]=4 518 B14R1.3135 O=Cc1ccccc1CC(=O)C(O)O 1458a_100000233687_200009853537 [0,0,1,0,0,1|1,0,1]=4 519 B14R1.965 C=CCC(=O)Cc1ccccc1C=O 1458a_100000210193_200009853537 [0,0,1,0,0,1|1,0,1]=4 520 B14R1.965 C=Cc1ccccc1NC(=O)C=CBr 1626a_100012022501_100016273825 [0,0,1,0,0,1|2,0,0]=4 521 B14R1.965 C=Cc1ccccc1NC(=O)C=CC 11a_100012022501_100000210699 [0,0,1,0,0,1|2,0,0]=4 522 B14R1.965 C=Cc1ccccc1NC(=O)C=CC 1626a_100012022501_100000210699 [0,0,1,0,0,1|2,0,0]=4 523 B14R1.965 C=Cc1ccccc1NC(=O)C=CC 22a_100012022501_100000210699 [0,0,1,0,0,1|2,0,0]=4 524 B14R1.965 C=Cc1ccccc1NC(=O)C=CCl 11a_100012022501_200016279998 [0,0,1,0,0,1|2,0,0]=4 525 B14R1.965 C=Cc1ccccc1NC(=O)C=CCl 1626a_100012022501_200016279998 [0,0,1,0,0,1|2,0,0]=4 526 B14R1.965 C=Cc1ccccc1NC(=O)C=CI 1626a_100012022501_100016256311 [0,0,1,0,0,1|2,0,0]=4 527 B14R1.965 CC=CC(=O)Cc1ccccc1C=O 1458a_100000210699_200009853537 [0,0,1,0,0,1|1,0,0]=3 528 B14R1.965 O=Cc1ccccc1CC(=O)C=CBr 1458a_100016273825_200009853537 [0,0,1,0,0,1|1,0,0]=3 529 B14R1.965 O=Cc1ccccc1CC(=O)C=CCl 1458a_200016279998_200009853537 [0,0,1,0,0,1|1,0,0]=3 530 B14R1.965 O=Cc1ccccc1CC(=O)C=CI 1458a_100016256311_200009853537 [0,0,1,0,0,1|1,0,0]=3 531 B14R1.965 O=Cc1ccccc1CC(=O)CCO 1458a_100011216618_200009853537 [0,0,1,0,0,1|0,0,2]=4 532 B14R1.3302 C=C(C)c1ccccc1NC(=O)CO 22a_100000037685_100000210174 [0,0,1,0,0,1|1,0,1]=4 533 B14R1.3302 C=CC(=O)Nc1ccccc1C(=C)C 1626a_100000037685_100000185746 [0,0,1,0,0,1|2,0,0]=4 534 B14R1.3302 C=CC(=O)Nc1ccccc1C(=C)C 22a_100000037685_100000185746 [0,0,1,0,0,1|2,0,0]=4 535 B14R1.3302 C=CC(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100000185746 [0,0,1,0,0,1|2,0,0]=4 536 B14R1.3302 C=CC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100000185746 [0,0,1,0,0,1|2,0,0]=4 537 B14R1.3302 NC(=O)c1ccccc1NC(=O)CO 22a_100000185089_100000210174 [0,0,1,0,0,1|1,0,1]=4