0 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [0,0,0,0,0,0|2,0,0]=2 6 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [0,0,0,0,0,0|1,0,0]=1 7 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [0,0,0,0,0,0|3,0,0]=3 10 B12R2.1081 Oc1ccnc2c1nccn2 271570a_203496583355_100010783457 [0,0,0,0,0,0|2,0,0]=2 11 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [0,0,0,0,0,0|3,0,0]=3 13 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [0,0,0,0,0,0|2,0,0]=2 14 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [0,0,0,0,0,0|4,0,0]=4 15 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [0,0,0,0,0,0|3,0,0]=3 17 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [0,0,0,0,0,0|2,0,0]=2 18 B12R2.1081 Oc1ncnc2c1cccn2 271570a_203496583355_100000026734 [0,0,0,0,0,0|4,0,0]=4 19 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,0|2,0,0]=3 20 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,1,0,0,0,0|1,0,0]=2 21 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,1,0,0,0,0|1,0,0]=2 22 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [0,1,0,0,0,0|0,0,0]=1 23 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,0,0,0|3,0,0]=4 24 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,0|3,0,0]=4 25 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [0,1,0,0,0,0|2,0,0]=3 26 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.32 Nc1ccc2nccnc2c1O 271570a_203496583355_100000729981 [0,1,0,0,0,0|1,0,0]=2 29 B13R2.32 Nc1cnc2cccnc2c1O 271570a_203496583355_100009889961 [0,1,0,0,0,0|3,0,0]=4 30 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,0,0,0|3,0,0]=4 31 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,0|3,0,0]=4 32 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,0|3,0,0]=4 35 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [0,1,0,0,0,0|2,0,0]=3 36 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,1,0,0,0,0|2,0,0]=3 37 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,1,0,0,0,0|2,0,0]=3 38 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,1,0,0,0,0|2,0,0]=3 39 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [0,1,0,0,0,0|3,0,0]=4 40 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,0|2,0,0]=3 41 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,0|1,0,0]=2 42 B13R2.162 Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100009817033 [0,1,0,0,0,0|3,0,0]=4 43 B13R2.162 Cc1nccc2c1cc(cc2)O 271570a_203496583355_200010739692 [0,1,0,0,0,0|3,0,0]=4 44 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [0,1,0,0,0,0|2,0,0]=3 45 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,0|3,0,0]=4 46 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,0|2,0,0]=3 47 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [0,1,0,0,0,0|3,0,0]=4 48 B13R2.162 O=c1[nH]ccc2c1cc(cn2)O 271570a_203496583355_100010134370 [0,1,0,0,0,0|3,0,0]=4 49 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,0|2,0,1]=4 50 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,0|3,0,0]=4 51 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,0|3,0,0]=4 52 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,0|2,0,0]=3 53 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,0|2,0,0]=3 54 B13R2.162 Oc1ccc2cncc(c2n1)O 271570a_203496583355_100009812673 [0,1,0,0,0,0|3,0,0]=4 55 B13R2.162 Oc1ccnc2c1nc(cc2)F 271570a_203496583355_100000719316 [0,1,0,0,0,0|3,0,0]=4 56 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,0|2,0,0]=3 57 B13R2.162 Oc1cnc2ncnc(c2n1)O 271570a_203496583355_100010174828 [0,1,0,0,0,0|3,0,0]=4 58 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [0,1,0,0,0,0|3,0,0]=4 59 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [0,1,0,0,0,0|3,0,0]=4 60 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [0,1,0,0,0,0|2,0,0]=3 61 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [0,1,0,0,0,0|1,0,0]=2 62 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [0,1,0,0,0,0|0,0,0]=1 63 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,0|3,0,0]=4 64 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [0,1,0,0,0,0|3,0,0]=4 65 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,0|3,0,0]=4 66 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [0,1,0,0,0,0|2,0,0]=3 67 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [0,1,0,0,0,0|2,0,0]=3 68 B13R2.328 Nc1cc2cccnc2c(n1)O 271570a_203496583355_100010205410 [0,1,0,0,0,0|3,0,0]=4 69 B13R2.328 O=c1cc(c2cccnc2[nH]1)O 271570a_203496583355_100010499609 [0,1,0,0,0,0|3,0,0]=4 70 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,0|3,0,0]=4 71 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,0|3,0,0]=4 72 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [0,1,0,0,0,0|2,0,0]=3 73 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [0,1,0,0,0,0|2,0,0]=3 74 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [0,1,0,0,0,0|2,0,0]=3 75 B13R2.328 Oc1cc(c2nccnc2c1)F 271570a_203496583355_100010079260 [0,1,0,0,0,0|1,0,0]=2 76 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [0,1,0,0,0,0|2,0,0]=3 77 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [0,1,0,0,0,0|2,0,0]=3 78 B13R2.328 Oc1cc(cc2c1nccn2)F 271570a_203496583355_100011083936 [0,1,0,0,0,0|1,0,0]=2 79 B13R2.342 Cc1cccc2c1ccnc2O 271570a_203496583355_100012002547 [0,1,0,0,0,0|3,0,0]=4 80 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [0,1,0,0,0,0|1,0,0]=2 81 B13R2.342 Cc1cccc2c1ncnc2O 271570a_203496583355_100000751292 [0,1,0,0,0,0|2,0,0]=3 82 B13R2.342 Cc1ccnc2c1cccc2O 271570a_203496583355_100010254272 [0,1,0,0,0,0|2,0,0]=3 83 B13R2.342 Cc1ccnc2c1nccc2O 271570a_203496583355_200013369187 [0,1,0,0,0,0|2,0,0]=3 84 B13R2.342 Cc1nccc2c1cccc2O 271570a_203496583355_100010137443 [0,1,0,0,0,0|3,0,0]=4 85 B13R2.342 Nc1cccc2c1cccc2O 271570a_203496583355_100009816864 [0,1,0,0,0,0|3,0,0]=4 86 B13R2.342 Nc1cccc2c1nccc2O 271570a_203496583355_100009892510 [0,1,0,0,0,0|2,0,0]=3 87 B13R2.342 Nc1ccnc2c1cccc2O 271570a_203496583355_100011620713 [0,1,0,0,0,0|2,0,0]=3 88 B13R2.342 Nc1ncnc2c1cccc2O 271570a_203496583355_100010199759 [0,1,0,0,0,0|3,0,0]=4 89 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [0,1,0,0,0,0|2,0,1]=4 90 B13R2.342 Oc1cccc2c1cccc2F 271570a_203496583355_100009817034 [0,1,0,0,0,0|3,0,0]=4 91 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [0,1,0,0,0,0|3,0,0]=4 92 B13R2.342 Oc1ccnc2c1cccc2F 271570a_203496583355_100011934723 [0,1,0,0,0,0|2,0,0]=3 93 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [0,1,0,0,0,0|2,0,0]=3 94 B13R2.342 Oc1ncnc2c1cccc2F 271570a_203496583355_100000693626 [0,1,0,0,0,0|3,0,0]=4 95 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [0,1,0,0,0,0|3,0,0]=4 96 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [0,1,0,0,0,0|2,0,0]=3 97 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [0,1,0,0,0,0|1,0,0]=2 98 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [0,1,0,0,0,0|3,0,0]=4 99 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [0,1,0,0,0,0|3,0,0]=4 100 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [0,1,0,0,0,0|3,0,0]=4 101 B13R2.371 Nc1ccc(c2c1cccn2)O 271570a_203496583355_100012360041 [0,1,0,0,0,0|2,0,0]=3 102 B13R2.371 Nc1ccc(c2c1nccc2)O 271570a_203496583355_100000726955 [0,1,0,0,0,0|2,0,0]=3 103 B13R2.371 Nc1ncc(c2c1cccn2)O 271570a_203496583355_100010383929 [0,1,0,0,0,0|3,0,0]=4 104 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [0,1,0,0,0,0|3,0,0]=4 105 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [0,1,0,0,0,0|3,0,0]=4 106 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [0,1,0,0,0,0|3,0,0]=4 107 B13R2.371 Oc1ccc(c2c1cccn2)F 271570a_203496583355_100010245834 [0,1,0,0,0,0|2,0,0]=3 108 B13R2.371 Oc1ccc(c2c1cccn2)O 271570a_203496583355_100011934063 [0,1,0,0,0,0|2,0,0]=3 109 B13R2.371 Oc1ccc(c2c1nccc2)F 271570a_203496583355_100010214461 [0,1,0,0,0,0|2,0,0]=3 110 B13R2.1613 C=Cc1cccc2c1cccc2 271570a_100011290941_100000210605 [0,1,0,0,0,0|2,0,1]=4 111 B13R2.1613 C=Cc1cccc2c1cccn2 271570a_100011290941_100011290932 [0,1,0,0,0,0|1,0,1]=3 112 B13R2.1613 C=Cc1cccc2c1cncn2 271570a_100011290941_100009814520 [0,1,0,0,0,0|2,0,1]=4 113 B13R2.1613 C=Cc1cccc2c1nccc2 271570a_100011290941_100011215545 [0,1,0,0,0,0|1,0,1]=3 114 B13R2.1613 C=Cc1cccc2c1nccn2 271570a_100011290941_100010003881 [0,1,0,0,0,0|0,0,1]=2 115 B13R2.1613 C=Cc1cccc2c1ncnc2 271570a_100011290941_100010246313 [0,1,0,0,0,0|2,0,1]=4 116 B13R2.1613 C=Cc1ccnc2c1cccn2 271570a_100011290941_100000087570 [0,1,0,0,0,0|2,0,1]=4 117 B13R2.1613 C=Cc1ccnc2c1nccn2 271570a_100011290941_100010783457 [0,1,0,0,0,0|1,0,1]=3 118 B13R2.1613 C=Cc1cncc2c1cccn2 271570a_100011290941_100010211308 [0,1,0,0,0,0|2,0,1]=4 119 B13R2.1613 C=Cc1cncc2c1nccn2 271570a_100011290941_200010209543 [0,1,0,0,0,0|1,0,1]=3 120 B13R2.1613 C=Cc1nccc2c1cccn2 271570a_100011290941_100000077681 [0,1,0,0,0,0|2,0,1]=4 121 B13R2.1613 C=Cc1nccc2c1nccc2 271570a_100011290941_100010063729 [0,1,0,0,0,0|2,0,1]=4 122 B13R2.1613 C=Cc1nccc2c1nccn2 271570a_100011290941_100010063732 [0,1,0,0,0,0|1,0,1]=3 123 B13R2.1613 CNc1cccc2c1cccc2 34a_100000185869_200000210301 [0,1,0,0,0,0|2,0,0]=3 124 B13R2.1613 CNc1cccc2c1cccn2 27a_100102657272_100011290932 [0,1,0,0,0,0|1,0,0]=2 125 B13R2.1613 CNc1cccc2c1cccn2 34a_100000183906_200000210301 [0,1,0,0,0,0|1,0,0]=2 126 B13R2.1613 CNc1cccc2c1cncn2 27a_100102657272_100009814520 [0,1,0,0,0,0|2,0,0]=3 127 B13R2.1613 CNc1cccc2c1nccc2 34a_100000181377_200000210301 [0,1,0,0,0,0|1,0,0]=2 128 B13R2.1613 CNc1cccc2c1nccn2 27a_100102657272_100010003881 [0,1,0,0,0,0|0,0,0]=1 129 B13R2.1613 CNc1cccc2c1ncnc2 27a_100102657272_100010246313 [0,1,0,0,0,0|2,0,0]=3 130 B13R2.1613 CNc1ccnc2c1cccc2 27a_100102657272_100011215880 [0,1,0,0,0,0|3,0,0]=4 131 B13R2.1613 CNc1ccnc2c1cccn2 27a_100102657272_100000087570 [0,1,0,0,0,0|2,0,0]=3 132 B13R2.1613 CNc1ccnc2c1nccn2 27a_100102657272_100010783457 [0,1,0,0,0,0|1,0,0]=2 133 B13R2.1613 CNc1cncc2c1cccn2 27a_100102657272_100010211308 [0,1,0,0,0,0|2,0,0]=3 134 B13R2.1613 CNc1cncc2c1nccn2 27a_100102657272_200010209543 [0,1,0,0,0,0|1,0,0]=2 135 B13R2.1613 CNc1nccc2c1cccc2 27a_100102657272_100011934041 [0,1,0,0,0,0|3,0,0]=4 136 B13R2.1613 CNc1nccc2c1cccn2 27a_100102657272_100000077681 [0,1,0,0,0,0|2,0,0]=3 137 B13R2.1613 CNc1nccc2c1nccc2 27a_100102657272_100010063729 [0,1,0,0,0,0|2,0,0]=3 138 B13R2.1613 CNc1nccc2c1nccn2 27a_100102657272_100010063732 [0,1,0,0,0,0|1,0,0]=2 139 B13R2.1613 CNc1ncnc2c1cccn2 27a_100102657272_100000026734 [0,1,0,0,0,0|3,0,0]=4 140 B13R2.1613 CNc1ncnc2c1nccc2 27a_100102657272_100000063688 [0,1,0,0,0,0|3,0,0]=4 141 B13R2.1613 COc1cccc2c1CC=CC2 34a_100000074931_200000210301 [0,1,0,0,0,0|2,0,0]=3 142 B13R2.1613 COc1cccc2c1CC=CC2 7a_100000074931_200000210301 [0,1,0,0,0,0|2,0,0]=3 143 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [0,1,0,0,0,0|2,0,0]=3 144 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [0,1,0,0,0,0|2,0,0]=3 145 B13R2.1613 COc1cccc2c1cccn2 34a_100011197808_200000210301 [0,1,0,0,0,0|1,0,0]=2 146 B13R2.1613 COc1cccc2c1ccnc2 34a_100011218533_200000210301 [0,1,0,0,0,0|3,0,0]=4 147 B13R2.1613 COc1cccc2c1cncc2 34a_103624766955_200000210301 [0,1,0,0,0,0|3,0,0]=4 148 B13R2.1613 COc1cccc2c1nccc2 34a_100000056035_200000210301 [0,1,0,0,0,0|1,0,0]=2 149 B13R2.1613 COc1cccc2c1nccn2 34a_100000077048_200000210301 [0,1,0,0,0,0|0,0,0]=1 150 B13R2.1613 COc1cccc2c1ncnc2 34a_200000077003_200000210301 [0,1,0,0,0,0|2,0,0]=3 151 B13R2.1613 COc1cncc2c1cccc2 34a_100000066178_200000210301 [0,1,0,0,0,0|3,0,0]=4 152 B13R2.1613 COc1cncc2c1cccc2 7a_100000066178_200000210301 [0,1,0,0,0,0|3,0,0]=4 153 B13R2.1613 COc1nccc2c1cccc2 34a_102531767632_200000210301 [0,1,0,0,0,0|3,0,0]=4 154 B13R2.1613 CSc1cccc2c1cccc2 62a_200000210301_100000210605 [0,1,0,0,0,0|2,0,0]=3 155 B13R2.1613 CSc1cccc2c1cccn2 62a_100011290932_200000210301 [0,1,0,0,0,0|1,0,0]=2 156 B13R2.1613 CSc1cccc2c1cccn2 62a_200000210301_100011290932 [0,1,0,0,0,0|1,0,0]=2 157 B13R2.1613 CSc1cccc2c1ccnc2 62a_100000186358_200000210301 [0,1,0,0,0,0|3,0,0]=4 158 B13R2.1613 CSc1cccc2c1ccnc2 62a_200000210301_100000186358 [0,1,0,0,0,0|3,0,0]=4 159 B13R2.1613 CSc1cccc2c1cncc2 62a_100000685578_200000210301 [0,1,0,0,0,0|3,0,0]=4 160 B13R2.1613 CSc1cccc2c1cncc2 62a_200000210301_100000685578 [0,1,0,0,0,0|3,0,0]=4 161 B13R2.1613 CSc1cccc2c1cncn2 62a_100009814520_200000210301 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.1613 CSc1cccc2c1cncn2 62a_200000210301_100009814520 [0,1,0,0,0,0|2,0,0]=3 163 B13R2.1613 CSc1cccc2c1nccc2 62a_200000210301_100011215545 [0,1,0,0,0,0|1,0,0]=2 164 B13R2.1613 CSc1cccc2c1nccn2 62a_100010003881_200000210301 [0,1,0,0,0,0|0,0,0]=1 165 B13R2.1613 CSc1cccc2c1nccn2 62a_200000210301_100010003881 [0,1,0,0,0,0|0,0,0]=1 166 B13R2.1613 CSc1cccc2c1ncnc2 62a_100010246313_200000210301 [0,1,0,0,0,0|2,0,0]=3 167 B13R2.1613 CSc1cccc2c1ncnc2 62a_200000210301_100010246313 [0,1,0,0,0,0|2,0,0]=3 168 B13R2.1613 CSc1ccnc2c1cccc2 62a_100011458314_200000210301 [0,1,0,0,0,0|3,0,0]=4 169 B13R2.1613 CSc1ccnc2c1cccc2 62a_200000210301_100011215880 [0,1,0,0,0,0|3,0,0]=4 170 B13R2.1613 CSc1ccnc2c1cccn2 62a_100000087570_200000210301 [0,1,0,0,0,0|2,0,0]=3 171 B13R2.1613 CSc1ccnc2c1cccn2 62a_200000210301_100000087570 [0,1,0,0,0,0|2,0,0]=3 172 B13R2.1613 CSc1ccnc2c1nccn2 62a_100010783457_200000210301 [0,1,0,0,0,0|1,0,0]=2 173 B13R2.1613 CSc1ccnc2c1nccn2 62a_200000210301_100010783457 [0,1,0,0,0,0|1,0,0]=2 174 B13R2.1613 CSc1cncc2c1cccc2 62a_100000187577_200000210301 [0,1,0,0,0,0|3,0,0]=4 175 B13R2.1613 CSc1cncc2c1cccc2 62a_200000210301_100000187577 [0,1,0,0,0,0|3,0,0]=4 176 B13R2.1613 CSc1cncc2c1cccn2 62a_100010211308_200000210301 [0,1,0,0,0,0|2,0,0]=3 177 B13R2.1613 CSc1cncc2c1cccn2 62a_200000210301_100010211308 [0,1,0,0,0,0|2,0,0]=3 178 B13R2.1613 CSc1cncc2c1nccn2 62a_200000210301_200010209543 [0,1,0,0,0,0|1,0,0]=2 179 B13R2.1613 CSc1cncc2c1nccn2 62a_200010209543_200000210301 [0,1,0,0,0,0|1,0,0]=2 180 B13R2.1613 CSc1nccc2c1cccc2 62a_100011934041_200000210301 [0,1,0,0,0,0|3,0,0]=4 181 B13R2.1613 CSc1nccc2c1cccc2 62a_200000210301_100011934041 [0,1,0,0,0,0|3,0,0]=4 182 B13R2.1613 CSc1nccc2c1cccn2 62a_200000210301_100000077681 [0,1,0,0,0,0|2,0,0]=3 183 B13R2.1613 CSc1nccc2c1nccc2 62a_200000210301_100010063729 [0,1,0,0,0,0|2,0,0]=3 184 B13R2.1613 CSc1nccc2c1nccn2 62a_100010063732_200000210301 [0,1,0,0,0,0|1,0,0]=2 185 B13R2.1613 CSc1nccc2c1nccn2 62a_200000210301_100010063732 [0,1,0,0,0,0|1,0,0]=2 186 B13R2.1613 CSc1ncnc2c1cccn2 62a_100000026734_200000210301 [0,1,0,0,0,0|3,0,0]=4 187 B13R2.1613 CSc1ncnc2c1cccn2 62a_200000210301_100000026734 [0,1,0,0,0,0|3,0,0]=4 188 B13R2.1613 CSc1ncnc2c1nccc2 62a_200000210301_100000063688 [0,1,0,0,0,0|3,0,0]=4 189 B13R2.1613 [13CH3]Nc1cccc2c1cccc2 34a_100000185869_200025704644 [0,1,0,0,0,0|2,0,0]=3 190 B13R2.1613 [13CH3]Nc1cccc2c1cccn2 34a_100000183906_200025704644 [0,1,0,0,0,0|1,0,0]=2 191 B13R2.1613 [13CH3]Nc1cccc2c1nccc2 34a_100000181377_200025704644 [0,1,0,0,0,0|1,0,0]=2 192 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 34a_100000074931_200025704644 [0,1,0,0,0,0|2,0,0]=3 193 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 7a_100000074931_200025704644 [0,1,0,0,0,0|2,0,0]=3 194 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [0,1,0,0,0,0|2,0,0]=3 195 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [0,1,0,0,0,0|2,0,0]=3 196 B13R2.1613 [13CH3]Oc1cccc2c1cccn2 34a_100011197808_200025704644 [0,1,0,0,0,0|1,0,0]=2 197 B13R2.1613 [13CH3]Oc1cccc2c1ccnc2 34a_100011218533_200025704644 [0,1,0,0,0,0|3,0,0]=4 198 B13R2.1613 [13CH3]Oc1cccc2c1cncc2 34a_103624766955_200025704644 [0,1,0,0,0,0|3,0,0]=4 199 B13R2.1613 [13CH3]Oc1cccc2c1nccc2 34a_100000056035_200025704644 [0,1,0,0,0,0|1,0,0]=2 200 B13R2.1613 [13CH3]Oc1cccc2c1nccn2 34a_100000077048_200025704644 [0,1,0,0,0,0|0,0,0]=1 201 B13R2.1613 [13CH3]Oc1cccc2c1ncnc2 34a_200000077003_200025704644 [0,1,0,0,0,0|2,0,0]=3 202 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 34a_100000066178_200025704644 [0,1,0,0,0,0|3,0,0]=4 203 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 7a_100000066178_200025704644 [0,1,0,0,0,0|3,0,0]=4 204 B13R2.1613 [13CH3]Oc1nccc2c1cccc2 34a_102531767632_200025704644 [0,1,0,0,0,0|3,0,0]=4 205 B13R2.1613 [13CH3]Sc1cccc2c1cccc2 62a_200025704644_100000210605 [0,1,0,0,0,0|2,0,0]=3 206 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_100011290932_200025704644 [0,1,0,0,0,0|1,0,0]=2 207 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_200025704644_100011290932 [0,1,0,0,0,0|1,0,0]=2 208 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_100000186358_200025704644 [0,1,0,0,0,0|3,0,0]=4 209 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_200025704644_100000186358 [0,1,0,0,0,0|3,0,0]=4 210 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_100000685578_200025704644 [0,1,0,0,0,0|3,0,0]=4 211 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_200025704644_100000685578 [0,1,0,0,0,0|3,0,0]=4 212 B13R2.1613 [13CH3]Sc1cccc2c1cncn2 62a_100009814520_200025704644 [0,1,0,0,0,0|2,0,0]=3 213 B13R2.1613 [13CH3]Sc1cccc2c1cncn2 62a_200025704644_100009814520 [0,1,0,0,0,0|2,0,0]=3 214 B13R2.1613 [13CH3]Sc1cccc2c1nccc2 62a_200025704644_100011215545 [0,1,0,0,0,0|1,0,0]=2 215 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_100010003881_200025704644 [0,1,0,0,0,0|0,0,0]=1 216 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_200025704644_100010003881 [0,1,0,0,0,0|0,0,0]=1 217 B13R2.1613 [13CH3]Sc1cccc2c1ncnc2 62a_100010246313_200025704644 [0,1,0,0,0,0|2,0,0]=3 218 B13R2.1613 [13CH3]Sc1cccc2c1ncnc2 62a_200025704644_100010246313 [0,1,0,0,0,0|2,0,0]=3 219 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_100011458314_200025704644 [0,1,0,0,0,0|3,0,0]=4 220 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_200025704644_100011215880 [0,1,0,0,0,0|3,0,0]=4 221 B13R2.1613 [13CH3]Sc1ccnc2c1cccn2 62a_100000087570_200025704644 [0,1,0,0,0,0|2,0,0]=3 222 B13R2.1613 [13CH3]Sc1ccnc2c1cccn2 62a_200025704644_100000087570 [0,1,0,0,0,0|2,0,0]=3 223 B13R2.1613 [13CH3]Sc1ccnc2c1nccn2 62a_100010783457_200025704644 [0,1,0,0,0,0|1,0,0]=2 224 B13R2.1613 [13CH3]Sc1ccnc2c1nccn2 62a_200025704644_100010783457 [0,1,0,0,0,0|1,0,0]=2 225 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_100000187577_200025704644 [0,1,0,0,0,0|3,0,0]=4 226 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_200025704644_100000187577 [0,1,0,0,0,0|3,0,0]=4 227 B13R2.1613 [13CH3]Sc1cncc2c1cccn2 62a_100010211308_200025704644 [0,1,0,0,0,0|2,0,0]=3 228 B13R2.1613 [13CH3]Sc1cncc2c1cccn2 62a_200025704644_100010211308 [0,1,0,0,0,0|2,0,0]=3 229 B13R2.1613 [13CH3]Sc1cncc2c1nccn2 62a_200010209543_200025704644 [0,1,0,0,0,0|1,0,0]=2 230 B13R2.1613 [13CH3]Sc1cncc2c1nccn2 62a_200025704644_200010209543 [0,1,0,0,0,0|1,0,0]=2 231 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_100011934041_200025704644 [0,1,0,0,0,0|3,0,0]=4 232 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_200025704644_100011934041 [0,1,0,0,0,0|3,0,0]=4 233 B13R2.1613 [13CH3]Sc1nccc2c1cccn2 62a_200025704644_100000077681 [0,1,0,0,0,0|2,0,0]=3 234 B13R2.1613 [13CH3]Sc1nccc2c1nccc2 62a_200025704644_100010063729 [0,1,0,0,0,0|2,0,0]=3 235 B13R2.1613 [13CH3]Sc1nccc2c1nccn2 62a_100010063732_200025704644 [0,1,0,0,0,0|1,0,0]=2 236 B13R2.1613 [13CH3]Sc1nccc2c1nccn2 62a_200025704644_100010063732 [0,1,0,0,0,0|1,0,0]=2 237 B13R2.1613 [13CH3]Sc1ncnc2c1cccn2 62a_100000026734_200025704644 [0,1,0,0,0,0|3,0,0]=4 238 B13R2.1613 [13CH3]Sc1ncnc2c1cccn2 62a_200025704644_100000026734 [0,1,0,0,0,0|3,0,0]=4 239 B13R2.1613 [13CH3]Sc1ncnc2c1nccc2 62a_200025704644_100000063688 [0,1,0,0,0,0|3,0,0]=4 240 B13R2.4818 Cc1cccc2c1c(ccc2)O 271570a_203496583355_100009995290 [0,1,0,0,0,0|2,0,0]=3 241 B13R2.4818 Cc1cncc2c1c(ccc2)O 271570a_203496583355_100009817140 [0,1,0,0,0,0|3,0,0]=4 242 B13R2.4818 Nc1cccc2c1c(ccc2)O 271570a_203496583355_100010002837 [0,1,0,0,0,0|3,0,0]=4 243 B13R2.4818 Nc1cccc2c1c(ccn2)O 271570a_203496583355_100010263589 [0,1,0,0,0,0|2,0,0]=3 244 B13R2.4818 Nc1ncnc2c1c(ccc2)O 271570a_203496583355_100010171649 [0,1,0,0,0,0|3,0,0]=4 245 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [0,1,0,0,0,0|3,0,0]=4 246 B13R2.4818 Oc1cccc2c1c(ccc2)Br 271570a_203496583355_100010243825 [0,1,0,0,0,0|3,0,0]=4 247 B13R2.4818 Oc1cccc2c1c(ccc2)F 271570a_203496583355_100010177852 [0,1,0,0,0,0|3,0,0]=4 248 B13R2.4818 Oc1cccc2c1c(ccc2)O 271570a_203496583355_100010089961 [0,1,0,0,0,0|3,0,0]=4 249 B13R2.4818 Oc1cccc2c1c(ccn2)O 271570a_203496583355_100010187735 [0,1,0,0,0,0|2,0,0]=3 250 B13R2.4818 Oc1ncnc2c1c(ccc2)F 271570a_203496583355_100000743342 [0,1,0,0,0,0|3,0,0]=4 251 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,0,0,0|2,0,0]=3 252 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,0|1,0,0]=2 253 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [0,1,0,0,0,0|3,0,0]=4 254 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [0,1,0,0,0,0|2,0,0]=3 255 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,0|3,0,0]=4 256 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,0|2,0,0]=3 257 B13R2.5179 Nc1ncc2c(cccc2n1)O 271570a_203496583355_100010209551 [0,1,0,0,0,0|3,0,0]=4 258 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,0|2,0,1]=4 259 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,0|3,0,0]=4 260 B13R2.5179 Oc1ccnc2c1ncc(c2)F 271570a_203496583355_100011072215 [0,1,0,0,0,0|3,0,0]=4 261 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,0|2,0,0]=3 262 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,0|2,0,0]=3 263 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,0|2,0,0]=3 264 B13R2.5179 Oc1cnc2c(nccc2c1)O 271570a_203496583355_100010117065 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.13 C=C=Cc1cccc(c1C)C 271570a_100015277604_100011214922 [0,0,1,0,0,0|2,0,1]=4 266 B11R1.13 C=C=Cc1cccc(c1Cl)C 271570a_100015277604_200012352035 [0,0,1,0,0,0|2,0,1]=4 267 B11R1.13 C=C=Cc1cccc(c1F)C 271570a_100015277604_100000717567 [0,0,1,0,0,0|2,0,1]=4 268 B11R1.13 C=C=Cc1cccc(c1N)C 271570a_100015277604_100011834072 [0,0,1,0,0,0|1,0,2]=4 269 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,0,1,0,0,0|2,0,1]=4 270 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,0,1,0,0,0|2,0,1]=4 271 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,0,1,0,0,0|2,0,1]=4 272 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,0,1,0,0,0|2,0,1]=4 273 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,0,1,0,0,0|1,0,2]=4 274 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,0,1,0,0,0|2,0,1]=4 275 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [0,0,1,0,0,0|1,0,2]=4 276 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,0,1,0,0,0|2,0,1]=4 277 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,0,1,0,0,0|2,0,1]=4 278 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [0,0,1,0,0,0|2,0,1]=4 279 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [0,0,1,0,0,0|2,0,1]=4 280 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,0,1,0,0,0|2,0,1]=4 281 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,0,1,0,0,0|1,0,2]=4 282 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,0,1,0,0,0|2,0,1]=4 283 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,0,1,0,0,0|2,0,1]=4 284 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,0,1,0,0,0|2,0,1]=4 285 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,0,1,0,0,0|2,0,1]=4 286 B11R1.24 C=CCNc1cccc(c1)C 2230a_100000188690_100000210623 [0,0,1,0,0,0|1,0,2]=4 287 B11R1.24 C=CCNc1cccc(c1)C 34a_100000188690_100015514636 [0,0,1,0,0,0|1,0,2]=4 288 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [0,0,1,0,0,0|2,0,1]=4 289 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [0,0,1,0,0,0|2,0,1]=4 290 B11R1.24 C=CCSc1cccc(c1)C 62a_100000210623_100011215228 [0,0,1,0,0,0|2,0,1]=4 291 B11R1.24 C=CCSc1cccc(c1)C 62a_100011215228_100000210623 [0,0,1,0,0,0|2,0,1]=4 292 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [0,0,1,0,0,0|2,0,1]=4 293 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [0,0,1,0,0,0|1,0,2]=4 294 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [0,0,1,0,0,0|1,0,2]=4 295 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [0,0,1,0,0,0|2,0,1]=4 296 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [0,0,1,0,0,0|2,0,1]=4 297 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [0,0,1,0,0,0|2,0,1]=4 298 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [0,0,1,0,0,0|2,0,1]=4 299 B11R1.28 C/C=C/COc1cccnc1 34a_100000210849_100102629194 [0,0,1,0,0,0|2,0,1]=4 300 B11R1.28 C/C=C/COc1cccnc1 7a_100000210849_100102629194 [0,0,1,0,0,0|2,0,1]=4 301 B11R1.28 C/C=C/CSc1ccccn1 62a_100011216584_100102629194 [0,0,1,0,0,0|2,0,1]=4 302 B11R1.28 C/C=C/CSc1ccccn1 62a_100102629194_100011216584 [0,0,1,0,0,0|2,0,1]=4 303 B11R1.28 C/C=C/CSc1cccnc1 62a_100000210063_100102629194 [0,0,1,0,0,0|2,0,1]=4 304 B11R1.28 C/C=C/CSc1cccnc1 62a_100102629194_100000210063 [0,0,1,0,0,0|2,0,1]=4 305 B11R1.28 C/C=C/CSc1cnccn1 62a_100000211759_100102629194 [0,0,1,0,0,0|1,0,1]=3 306 B11R1.28 C/C=C/CSc1cnccn1 62a_100102629194_100000211759 [0,0,1,0,0,0|1,0,1]=3 307 B11R1.28 CC=CCOc1cccnc1 34a_100000210849_100000070051 [0,0,1,0,0,0|2,0,1]=4 308 B11R1.28 CC=CCOc1cccnc1 7a_100000210849_100000070051 [0,0,1,0,0,0|2,0,1]=4 309 B11R1.28 CC=CCSc1ccccn1 62a_100000070051_100011216584 [0,0,1,0,0,0|2,0,1]=4 310 B11R1.28 CC=CCSc1ccccn1 62a_100011216584_100000070051 [0,0,1,0,0,0|2,0,1]=4 311 B11R1.28 CC=CCSc1cccnc1 62a_100000070051_100000210063 [0,0,1,0,0,0|2,0,1]=4 312 B11R1.28 CC=CCSc1cccnc1 62a_100000210063_100000070051 [0,0,1,0,0,0|2,0,1]=4 313 B11R1.28 CC=CCSc1cnccn1 62a_100000070051_100000211759 [0,0,1,0,0,0|1,0,1]=3 314 B11R1.28 CC=CCSc1cnccn1 62a_100000211759_100000070051 [0,0,1,0,0,0|1,0,1]=3 315 B11R1.28 CCC=NNc1cnccn1 4a_100000736894_100000210100 [0,0,1,0,0,0|2,0,1]=4 316 B11R1.28 CCCC=Cc1ccccn1 271570a_100016258520_100011216584 [0,0,1,0,0,0|1,0,2]=4 317 B11R1.28 CCCC=Cc1cccnc1 271570a_100016258520_100000752921 [0,0,1,0,0,0|1,0,2]=4 318 B11R1.28 CCCC=Cc1cnccn1 271570a_100016258520_100000758340 [0,0,1,0,0,0|0,0,2]=3 319 B11R1.28 CCNN=Cc1cnccn1 4a_100000756455_100000749867 [0,0,1,0,0,0|2,0,1]=4 320 B11R1.28 CCOC=Cc1ccccn1 271570a_100016256518_100011216584 [0,0,1,0,0,0|2,0,1]=4 321 B11R1.28 CCOC=Cc1cccnc1 271570a_100016256518_100000752921 [0,0,1,0,0,0|2,0,1]=4 322 B11R1.28 CCOC=Cc1cnccn1 271570a_100016256518_100000758340 [0,0,1,0,0,0|1,0,1]=3 323 B11R1.28 COC/C=C/c1cccnc1 34a_200102594124_200000210301 [0,0,1,0,0,0|2,0,1]=4 324 B11R1.28 COCC=Cc1ccccn1 271570a_100016286323_100011216584 [0,0,1,0,0,0|2,0,1]=4 325 B11R1.28 COCC=Cc1cccnc1 271570a_100016286323_100000752921 [0,0,1,0,0,0|2,0,1]=4 326 B11R1.28 COCC=Cc1cnccn1 271570a_100016286323_100000758340 [0,0,1,0,0,0|1,0,1]=3 327 B11R1.28 [13CH3]OC/C=C/c1cccnc1 34a_200102594124_200025704644 [0,0,1,0,0,0|2,0,1]=4 328 B11R1.41 C=C=Cc1cccnc1C=O 271570a_100015277604_100011934733 [0,0,1,0,0,0|2,0,1]=4 329 B11R1.41 C=C=Cc1cccnc1CC 271570a_100015277604_100009877225 [0,0,1,0,0,0|1,0,2]=4 330 B11R1.41 C=C=Cc1cccnc1NC 271570a_100015277604_100000700899 [0,0,1,0,0,0|2,0,1]=4 331 B11R1.41 C=C=Cc1cccnc1OC 271570a_100015277604_100000047025 [0,0,1,0,0,0|2,0,1]=4 332 B11R1.41 C=C=Cc1cccnc1SC 271570a_100015277604_100011465278 [0,0,1,0,0,0|2,0,1]=4 333 B11R1.41 C=C=Cc1ncccc1C=O 271570a_100015277604_100009816751 [0,0,1,0,0,0|2,0,1]=4 334 B11R1.41 C=C=Cc1ncccc1NC 271570a_100015277604_200011806188 [0,0,1,0,0,0|2,0,1]=4 335 B11R1.41 C=C=Cc1ncccc1OC 271570a_100015277604_100000690851 [0,0,1,0,0,0|2,0,1]=4 336 B11R1.41 C=C=Cc1nccnc1C#N 271570a_100015277604_100000040484 [0,0,1,0,0,0|1,0,2]=4 337 B11R1.41 C=C=Cc1nccnc1CC 271570a_100015277604_100011995844 [0,0,1,0,0,0|0,0,2]=3 338 B11R1.41 C=C=Cc1nccnc1CN 271570a_100015277604_100000729963 [0,0,1,0,0,0|1,0,2]=4 339 B11R1.41 C=C=Cc1nccnc1CO 271570a_100015277604_100000057004 [0,0,1,0,0,0|1,0,2]=4 340 B11R1.41 C=C=Cc1nccnc1NC 271570a_100015277604_100011529439 [0,0,1,0,0,0|1,0,1]=3 341 B11R1.41 C=C=Cc1nccnc1NN 271570a_100015277604_100000755098 [0,0,1,0,0,0|2,0,1]=4 342 B11R1.41 C=C=Cc1nccnc1OC 271570a_100015277604_100000749998 [0,0,1,0,0,0|1,0,1]=3 343 B11R1.41 CC=Cc1cccnc1C=O 271570a_100016259895_100011934733 [0,0,1,0,0,0|2,0,1]=4 344 B11R1.41 CC=Cc1cccnc1CC 271570a_100016259895_100009877225 [0,0,1,0,0,0|1,0,2]=4 345 B11R1.41 CC=Cc1cccnc1NC 271570a_100016259895_100000700899 [0,0,1,0,0,0|2,0,1]=4 346 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,0,1,0,0,0|2,0,1]=4 347 B11R1.41 CC=Cc1cccnc1SC 271570a_100016259895_100011465278 [0,0,1,0,0,0|2,0,1]=4 348 B11R1.41 CC=Cc1ncccc1C=O 271570a_100016259895_100009816751 [0,0,1,0,0,0|2,0,1]=4 349 B11R1.41 CC=Cc1ncccc1NC 271570a_100016259895_200011806188 [0,0,1,0,0,0|2,0,1]=4 350 B11R1.41 CC=Cc1ncccc1OC 271570a_100016259895_100000690851 [0,0,1,0,0,0|2,0,1]=4 351 B11R1.41 CC=Cc1nccnc1C#N 271570a_100016259895_100000040484 [0,0,1,0,0,0|1,0,2]=4 352 B11R1.41 CC=Cc1nccnc1CC 271570a_100016259895_100011995844 [0,0,1,0,0,0|0,0,2]=3 353 B11R1.41 CC=Cc1nccnc1CN 271570a_100016259895_100000729963 [0,0,1,0,0,0|1,0,2]=4 354 B11R1.41 CC=Cc1nccnc1CO 271570a_100016259895_100000057004 [0,0,1,0,0,0|1,0,2]=4 355 B11R1.41 CC=Cc1nccnc1NC 271570a_100016259895_100011529439 [0,0,1,0,0,0|1,0,1]=3 356 B11R1.41 CC=Cc1nccnc1NN 271570a_100016259895_100000755098 [0,0,1,0,0,0|2,0,1]=4 357 B11R1.41 CC=Cc1nccnc1OC 271570a_100016259895_100000749998 [0,0,1,0,0,0|1,0,1]=3 358 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [0,0,1,0,0,0|3,0,0]=4 359 B11R1.53 C=C(C)c1cccnc1C#N 271570a_100000694244_100000685805 [0,0,1,0,0,0|2,0,1]=4 360 B11R1.53 C=C(C)c1cccnc1C=O 271570a_100000694244_100011934733 [0,0,1,0,0,0|2,0,0]=3 361 B11R1.53 C=C(C)c1cccnc1CC 271570a_100000694244_100009877225 [0,0,1,0,0,0|1,0,2]=4 362 B11R1.53 C=C(C)c1cccnc1CN 271570a_100000694244_100020591323 [0,0,1,0,0,0|2,0,1]=4 363 B11R1.53 C=C(C)c1cccnc1CO 271570a_100000694244_100011996772 [0,0,1,0,0,0|2,0,1]=4 364 B11R1.53 C=C(C)c1cccnc1NC 271570a_100000694244_100000700899 [0,0,1,0,0,0|2,0,1]=4 365 B11R1.53 C=C(C)c1cccnc1NN 271570a_100000694244_100011464834 [0,0,1,0,0,0|3,0,0]=4 366 B11R1.53 C=C(C)c1cccnc1OC 271570a_100000694244_100000047025 [0,0,1,0,0,0|2,0,1]=4 367 B11R1.53 C=C(C)c1cccnc1SC 271570a_100000694244_100011465278 [0,0,1,0,0,0|2,0,1]=4 368 B11R1.53 C=C(C)c1ncccc1C#N 271570a_100000694244_100000211984 [0,0,1,0,0,0|2,0,1]=4 369 B11R1.53 C=C(C)c1ncccc1C=O 271570a_100000694244_100009816751 [0,0,1,0,0,0|2,0,0]=3 370 B11R1.53 C=C(C)c1ncccc1CN 271570a_100000694244_100015189234 [0,0,1,0,0,0|2,0,1]=4 371 B11R1.53 C=C(C)c1ncccc1CO 271570a_100000694244_100000748726 [0,0,1,0,0,0|2,0,1]=4 372 B11R1.53 C=C(C)c1ncccc1NC 271570a_100000694244_200011806188 [0,0,1,0,0,0|2,0,1]=4 373 B11R1.53 C=C(C)c1ncccc1OC 271570a_100000694244_100000690851 [0,0,1,0,0,0|2,0,1]=4 374 B11R1.53 C=C(C)c1nccnc1C#N 271570a_100000694244_100000040484 [0,0,1,0,0,0|1,0,1]=3 375 B11R1.53 C=C(C)c1nccnc1CC 271570a_100000694244_100011995844 [0,0,1,0,0,0|0,0,2]=3 376 B11R1.53 C=C(C)c1nccnc1CN 271570a_100000694244_100000729963 [0,0,1,0,0,0|1,0,1]=3 377 B11R1.53 C=C(C)c1nccnc1CO 271570a_100000694244_100000057004 [0,0,1,0,0,0|1,0,1]=3 378 B11R1.53 C=C(C)c1nccnc1NC 271570a_100000694244_100011529439 [0,0,1,0,0,0|1,0,1]=3 379 B11R1.53 C=C(C)c1nccnc1NN 271570a_100000694244_100000755098 [0,0,1,0,0,0|2,0,0]=3 380 B11R1.53 C=C(C)c1nccnc1OC 271570a_100000694244_100000749998 [0,0,1,0,0,0|1,0,1]=3 381 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [0,0,1,0,0,0|3,0,0]=4 382 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [0,0,1,0,0,0|3,0,0]=4 383 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [0,0,1,0,0,0|3,0,0]=4 384 B11R1.53 C=Cc1cccnc1C(=O)C 271570a_100011290941_100012348690 [0,0,1,0,0,0|2,0,0]=3 385 B11R1.53 C=Cc1cccnc1C(=O)N 271570a_100011290941_200012359670 [0,0,1,0,0,0|3,0,0]=4 386 B11R1.53 C=Cc1cccnc1C(C)N 271570a_100011290941_100159271932 [0,0,1,0,0,0|2,0,1]=4 387 B11R1.53 C=Cc1cccnc1N(C)C 271570a_100011290941_100011465059 [0,0,1,0,0,0|2,0,1]=4 388 B11R1.53 C=Cc1cccnc1[C@H](C)O 271570a_100011290941_100013325542 [0,0,1,0,0,0|2,0,1]=4 389 B11R1.53 C=Cc1ncccc1C(=O)C 271570a_100011290941_100000753718 [0,0,1,0,0,0|2,0,0]=3 390 B11R1.53 C=Cc1ncccc1C(=O)N 271570a_100011290941_100000162199 [0,0,1,0,0,0|3,0,0]=4 391 B11R1.53 C=Cc1ncccc1C(C)C 271570a_100011290941_200010382935 [0,0,1,0,0,0|1,0,2]=4 392 B11R1.53 C=Cc1ncccc1C(C)O 271570a_100011290941_100009865335 [0,0,1,0,0,0|2,0,1]=4 393 B11R1.53 C=Cc1nccnc1C(=O)C 271570a_100011290941_100000099859 [0,0,1,0,0,0|1,0,0]=2 394 B11R1.53 C=Cc1nccnc1C(=O)N 271570a_100011290941_100000094861 [0,0,1,0,0,0|2,0,0]=3 395 B11R1.53 C=Cc1nccnc1N(C)C 271570a_100011290941_100000703087 [0,0,1,0,0,0|1,0,1]=3 396 B11R1.53 CC(=O)c1nccnc1S[13CH3] 62a_100000099859_200025704644 [0,0,1,0,0,0|2,0,1]=4 397 B11R1.53 CC(=O)c1nccnc1S[13CH3] 62a_200025704644_100000099859 [0,0,1,0,0,0|2,0,1]=4 398 B11R1.53 CNc1nccnc1C(=O)C 27a_100102657272_100000099859 [0,0,1,0,0,0|2,0,1]=4 399 B11R1.53 CSc1nccnc1C(=O)C 62a_100000099859_200000210301 [0,0,1,0,0,0|2,0,1]=4 400 B11R1.53 CSc1nccnc1C(=O)C 62a_200000210301_100000099859 [0,0,1,0,0,0|2,0,1]=4 401 B11R1.265 C=Cc1c(cccc1C#N)C 271570a_100011290941_100011934862 [0,0,1,0,0,0|3,0,0]=4 402 B11R1.265 C=Cc1c(cccc1CC)C 271570a_100011290941_100000036235 [0,0,1,0,0,0|2,0,1]=4 403 B11R1.265 C=Cc1c(cccc1CO)C 271570a_100011290941_100011659289 [0,0,1,0,0,0|3,0,0]=4 404 B11R1.265 C=Cc1cccc(c1C#N)C 271570a_100011290941_100009819585 [0,0,1,0,0,0|3,0,0]=4 405 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [0,0,1,0,0,0|3,0,0]=4 406 B11R1.265 C=Cc1cccc(c1OC)C 271570a_100011290941_100010141385 [0,0,1,0,0,0|2,0,1]=4 407 B11R1.605 C=C=Cc1c(cccc1C)C 271570a_100015277604_100000033847 [0,0,1,0,0,0|2,0,1]=4 408 B11R1.605 C=C=Cc1c(cccc1Cl)C 271570a_100015277604_100000043165 [0,0,1,0,0,0|2,0,1]=4 409 B11R1.605 C=C=Cc1c(cccc1F)C 271570a_100015277604_100012349962 [0,0,1,0,0,0|2,0,1]=4 410 B11R1.605 C=C=Cc1c(cccc1N)C 271570a_100015277604_100000684715 [0,0,1,0,0,0|1,0,2]=4 411 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [0,0,1,0,0,0|2,0,1]=4 412 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [0,0,1,0,0,0|2,0,1]=4 413 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [0,0,1,0,0,0|2,0,1]=4 414 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [0,0,1,0,0,0|2,0,1]=4 415 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,0,1,0,0,0|1,0,2]=4 416 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,0,1,0,0,0|2,0,1]=4 417 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,1,0|3,0,0]=4 418 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [0,0,0,0,1,0|3,0,0]=4 419 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [0,0,0,0,1,0|3,0,0]=4 420 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,1,0|3,0,0]=4 421 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [0,0,0,0,1,0|3,0,0]=4 422 B11R2.1 Oc1csc2c1nccn2 271570a_203496583355_100010174841 [0,0,0,0,1,0|2,0,0]=3 423 B11R2.1 Oc1n[nH]c2c1nccn2 271570a_203496583355_100009819591 [0,0,0,0,1,0|3,0,0]=4 424 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [0,0,0,0,1,0|2,0,0]=3 425 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [0,0,0,0,1,0|1,0,1]=3 426 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [0,0,0,0,1,0|2,0,1]=4 427 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [0,0,0,0,1,0|2,0,1]=4 428 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [0,0,0,0,1,0|1,0,1]=3 429 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [0,0,0,0,1,0|2,0,0]=3 430 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [0,0,0,0,1,0|2,0,0]=3 431 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [0,0,0,0,1,0|2,0,1]=4 432 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [0,0,0,0,1,0|3,0,0]=4 433 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [0,0,0,0,1,0|1,0,1]=3 434 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [0,0,0,0,1,0|2,0,0]=3 435 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [0,0,0,0,1,0|2,0,0]=3 436 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [0,0,0,0,1,0|2,0,0]=3 437 B11R2.106 Oc1cccc2c1nsn2 271570a_203496583355_100000742359 [0,0,0,0,1,0|2,0,0]=3 438 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [0,0,0,0,1,0|2,0,0]=3 439 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [0,0,0,0,1,0|2,0,0]=3 440 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [0,0,0,0,1,0|3,0,0]=4 441 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [0,0,0,0,1,0|2,0,0]=3 442 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [0,0,0,0,1,0|2,0,0]=3 443 B11R2.106 Oc1cccc2n1ccn2 271570a_203496583355_100000762677 [0,0,0,0,1,0|2,0,0]=3 444 B11R2.106 Oc1cccc2n1cnn2 271570a_203496583355_100009819885 [0,0,0,0,1,0|3,0,0]=4 445 B11R2.106 Oc1cccc2n1ncc2 271570a_203496583355_100009817731 [0,0,0,0,1,0|2,0,0]=3 446 B11R2.106 Oc1cccc2n1ncn2 271570a_203496583355_100009819724 [0,0,0,0,1,0|2,0,0]=3 447 B11R2.106 Oc1cccn2c1ccn2 271570a_203496583355_100010767162 [0,0,0,0,1,0|2,0,0]=3 448 B11R2.106 Oc1cccn2c1ncc2 271570a_203496583355_100011934911 [0,0,0,0,1,0|2,0,0]=3 449 B11R2.106 Oc1cccn2c1ncn2 271570a_203496583355_100009819722 [0,0,0,0,1,0|2,0,0]=3 450 B11R2.106 Oc1cccn2c1nnc2 271570a_203496583355_100000764285 [0,0,0,0,1,0|3,0,0]=4 451 B11R2.106 Oc1cccn2c1nnn2 271570a_203496583355_100009852330 [0,0,0,0,1,0|3,0,0]=4 452 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [0,0,0,0,1,0|2,0,1]=4 453 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [0,0,0,0,1,0|2,0,1]=4 454 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [0,0,0,0,1,0|3,0,0]=4 455 B11R2.106 Oc1ccnc2c1nc[nH]2 271570a_203496583355_100009820729 [0,0,0,0,1,0|2,0,1]=4 456 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [0,0,0,0,1,0|3,0,0]=4 457 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [0,0,0,0,1,0|3,0,0]=4 458 B11R2.106 Oc1ccnc2n1ncc2 271570a_203496583355_100000080991 [0,0,0,0,1,0|3,0,0]=4 459 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [0,0,0,0,1,0|2,0,1]=4 460 B11R2.106 Oc1cncc2c1[nH]cn2 271570a_203496583355_100000759552 [0,0,0,0,1,0|2,0,1]=4 461 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [0,0,0,0,1,0|2,0,1]=4 462 B11R2.106 Oc1cncc2n1ccn2 271570a_203496583355_100009818520 [0,0,0,0,1,0|3,0,0]=4 463 B11R2.106 Oc1nc[nH]c-2nccc12 271570a_203496583355_100015350423 [0,0,0,0,1,0|3,0,0]=4 464 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [0,0,0,0,1,0|2,0,1]=4 465 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [0,0,0,0,1,0|2,0,1]=4 466 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [0,0,0,0,1,0|3,0,0]=4 467 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [0,0,0,0,1,0|3,0,0]=4 468 B11R2.106 Oc1nccc2c1nc[nH]2 271570a_203496583355_100009820035 [0,0,0,0,1,0|2,0,1]=4 469 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [0,0,0,0,1,0|3,0,0]=4 470 B11R2.106 Oc1nccn2c1ccn2 271570a_203496583355_100009846796 [0,0,0,0,1,0|3,0,0]=4 471 B11R2.106 Oc1nccn2c1ncc2 271570a_203496583355_100009887225 [0,0,0,0,1,0|3,0,0]=4 472 B11R2.106 Oc1nccn2c1ncn2 271570a_203496583355_100000094309 [0,0,0,0,1,0|3,0,0]=4 473 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,0,1,0,0,0|2,0,0]=4 474 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,0,1,0,0,0|2,0,0]=4 475 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,0,1,0,0,0|1,0,0]=3 476 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,0,1,0,0,0|2,0,0]=4 477 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,0,1,0,0,0|2,0,0]=4 478 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,0,1,0,0,0|2,0,0]=4 479 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,0,1,0,0,0|2,0,0]=4 480 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,0,1,0,0,0|2,0,0]=4 481 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,0,1,0,0,0|1,0,0]=3 482 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,0,1,0,0,0|2,0,0]=4 483 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,0,1,0,0,0|2,0,0]=4 484 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,0,1,0,0,0|2,0,0]=4 485 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,0,1,0,0,0|2,0,0]=4 486 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,0,1,0,0,0|1,0,0]=3 487 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,0,1,0,0,0|2,0,0]=4 488 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,0,1,0,0,0|2,0,0]=4 489 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,0,1,0,0,0|2,0,0]=4 490 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,0,1,0,0,0|2,0,0]=4 491 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,0,1,0,0,0|1,0,1]=4 492 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,0,1,0,0,0|0,0,1]=3 493 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,0,1,0,0,0|1,0,1]=4 494 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,0,1,0,0,0|1,0,1]=4 495 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,0,1,0,0,0|1,0,1]=4 496 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,0,1,0,0,0|1,0,1]=4 497 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,0,1,0,0,0|2,0,0]=4 498 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,0,1,0,0,0|1,0,0]=3 499 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,0,1,0,0,0|2,0,0]=4 500 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,0,1,0,0,0|2,0,0]=4 501 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,0,1,0,0,0|2,0,0]=4 502 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,0,1,0,0,0|2,0,0]=4 503 B10R1.2 C=Cc1cccn(c1=O)C 271570a_100011290941_100000687173 [1,0,1,0,0,0|2,0,0]=4 504 B10R1.2 C=Cc1ccnc(c1C)C 271570a_100011290941_100009846815 [1,0,1,0,0,0|2,0,0]=4 505 B10R1.2 C=Cc1ccnc(c1Cl)C 271570a_100011290941_100000698670 [1,0,1,0,0,0|2,0,0]=4 506 B10R1.2 C=Cc1ccnc(c1F)C 271570a_100011290941_100009849794 [1,0,1,0,0,0|2,0,0]=4 507 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [1,0,1,0,0,0|1,0,1]=4 508 B10R1.2 C=Cc1cncc(c1C)C 271570a_100011290941_100009864703 [1,0,1,0,0,0|2,0,0]=4 509 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,0,1,0,0,0|1,0,1]=4 510 B10R1.2 C=Cc1nccc(c1C)C 271570a_100011290941_100009847204 [1,0,1,0,0,0|2,0,0]=4 511 B10R1.2 C=Cc1nccc(c1F)C 271570a_100011290941_100009817629 [1,0,1,0,0,0|2,0,0]=4 512 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [1,0,1,0,0,0|1,0,1]=4 513 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,0,1,0,0,0|2,0,0]=4 514 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,0,1,0,0,0|1,0,1]=4 515 B10R1.4 C=C=Cc1cccnc1C 271570a_100015277604_100000751574 [1,0,1,0,0,0|1,0,1]=4 516 B10R1.4 C=C=Cc1ncccc1C 271570a_100015277604_100000751373 [1,0,1,0,0,0|1,0,1]=4 517 B10R1.4 C=C=Cc1nccnc1C 271570a_100015277604_100011999405 [1,0,1,0,0,0|0,0,1]=3 518 B10R1.4 C=C=Cc1nccnc1F 271570a_100015277604_200010125657 [1,0,1,0,0,0|1,0,1]=4 519 B10R1.4 C=C=Cc1nccnc1N 271570a_100015277604_100000747729 [1,0,1,0,0,0|1,0,1]=4 520 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,0,1,0,0,0|2,0,0]=4 521 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [1,0,1,0,0,0|2,0,0]=4 522 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,0,1,0,0,0|2,0,0]=4 523 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,0,1,0,0,0|1,0,0]=3 524 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,0,1,0,0,0|2,0,0]=4 525 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,0,1,0,0,0|2,0,0]=4 526 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,0,1,0,0,0|2,0,0]=4 527 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,0,1,0,0,0|2,0,0]=4 528 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [1,0,1,0,0,0|1,0,1]=4 529 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [1,0,1,0,0,0|2,0,0]=4 530 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [1,0,1,0,0,0|2,0,0]=4 531 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [1,0,1,0,0,0|1,0,1]=4 532 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [1,0,1,0,0,0|0,0,1]=3 533 B10R1.4 CC=Cc1nccnc1F 271570a_100016259895_200010125657 [1,0,1,0,0,0|1,0,1]=4 534 B10R1.4 CC=Cc1nccnc1N 271570a_100016259895_100000747729 [1,0,1,0,0,0|1,0,1]=4 535 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,0,1,0,0,0|1,0,1]=4 536 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,1,0,0,0|2,0,0]=4 537 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,0,1,0,0,0|2,0,0]=4 538 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,0,1,0,0,0|2,0,0]=4 539 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,0,1,0,0,0|2,0,0]=4 540 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,1,0,0,0|1,0,0]=3 541 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,0,1,0,0,0|2,0,0]=4 542 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,0,1,0,0,0|2,0,0]=4 543 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,0,1,0,0,0|2,0,0]=4 544 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,1,0,0,0|2,0,0]=4 545 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,0,1,0,0,0|2,0,0]=4 546 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,0,1,0,0,0|2,0,0]=4 547 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,0,1,0,0,0|2,0,0]=4 548 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,0,1,0,0,0|2,0,0]=4 549 B10R1.17 C=CCNc1cnccn1 27a_100020586998_100000211759 [1,0,1,0,0,0|1,0,1]=4 550 B10R1.17 C=CCSc1cnccn1 62a_100000210623_100000211759 [1,0,1,0,0,0|1,0,1]=4 551 B10R1.17 C=CCSc1cnccn1 62a_100000211759_100000210623 [1,0,1,0,0,0|1,0,1]=4 552 B10R1.17 CC=NNc1cnccn1 4a_100000736894_200000210099 [1,0,1,0,0,0|2,0,0]=4 553 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,0,1,0,0,0|2,0,0]=4 554 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [1,0,1,0,0,0|1,0,1]=4 555 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [1,0,1,0,0,0|2,0,0]=4 556 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [1,0,1,0,0,0|2,0,0]=4 557 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [1,0,1,0,0,0|2,0,0]=4 558 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,0,1,0,0,0|2,0,0]=4 559 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [1,0,1,0,0,0|2,0,0]=4 560 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [1,0,1,0,0,0|2,0,0]=4 561 B10R1.20 C=Cc1nccnc1C#N 271570a_100011290941_100000040484 [1,0,1,0,0,0|1,0,1]=4 562 B10R1.20 C=Cc1nccnc1CC 271570a_100011290941_100011995844 [1,0,1,0,0,0|0,0,1]=3 563 B10R1.20 C=Cc1nccnc1CN 271570a_100011290941_100000729963 [1,0,1,0,0,0|1,0,1]=4 564 B10R1.20 C=Cc1nccnc1CO 271570a_100011290941_100000057004 [1,0,1,0,0,0|1,0,1]=4 565 B10R1.20 C=Cc1nccnc1NC 271570a_100011290941_100011529439 [1,0,1,0,0,0|1,0,0]=3 566 B10R1.20 C=Cc1nccnc1NN 271570a_100011290941_100000755098 [1,0,1,0,0,0|2,0,0]=4 567 B10R1.20 C=Cc1nccnc1OC 271570a_100011290941_100000749998 [1,0,1,0,0,0|1,0,0]=3 568 B10R1.20 CSc1nccnc1C=O 62a_100000051000_200000210301 [1,0,1,0,0,0|2,0,0]=4 569 B10R1.20 CSc1nccnc1C=O 62a_200000210301_100000051000 [1,0,1,0,0,0|2,0,0]=4 570 B10R1.20 [13CH3]Sc1nccnc1C=O 62a_100000051000_200025704644 [1,0,1,0,0,0|2,0,0]=4 571 B10R1.20 [13CH3]Sc1nccnc1C=O 62a_200025704644_100000051000 [1,0,1,0,0,0|2,0,0]=4 572 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,0,1,0,0,0|2,0,0]=4 573 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,0,1,0,0,0|1,0,1]=4 574 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,0,1,0,0,0|2,0,0]=4 575 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,0,1,0,0,0|2,0,0]=4 576 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,0,1,0,0,0|2,0,0]=4 577 B10R1.61 C=C(C)c1ncc[nH]c1=O 271570a_100000694244_100000763361 [1,0,1,0,0,0|1,0,1]=4 578 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,0,1,0,0,0|2,0,0]=4 579 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,0,1,0,0,0|1,0,1]=4 580 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,0,1,0,0,0|2,0,0]=4 581 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,0,1,0,0,0|2,0,0]=4 582 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,0,1,0,0,0|2,0,0]=4 583 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,0,1,0,0,0|2,0,0]=4 584 B10R1.61 C=C(C)c1nccnc1C 271570a_100000694244_100011999405 [1,0,1,0,0,0|0,0,1]=3 585 B10R1.61 C=C(C)c1nccnc1F 271570a_100000694244_200010125657 [1,0,1,0,0,0|1,0,0]=3 586 B10R1.61 C=C(C)c1nccnc1N 271570a_100000694244_100000747729 [1,0,1,0,0,0|1,0,0]=3 587 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,0,1,0,0,0|2,0,0]=4 588 B10R1.245 C=Cc1c(ccc[n+]1[O-])C 271570a_100011290941_100116209805 [1,0,1,0,0,0|2,0,0]=4 589 B10R1.245 C=Cc1c(cccc1Br)Br 271570a_100011290941_100009994525 [1,0,1,0,0,0|2,0,0]=4 590 B10R1.245 C=Cc1c(cccc1Br)Cl 271570a_100011290941_100010214488 [1,0,1,0,0,0|2,0,0]=4 591 B10R1.245 C=Cc1c(cccc1Br)F 271570a_100011290941_100011219512 [1,0,1,0,0,0|2,0,0]=4 592 B10R1.245 C=Cc1c(cccc1Br)N 271570a_100011290941_100020590159 [1,0,1,0,0,0|1,0,1]=4 593 B10R1.245 C=Cc1c(cccc1Br)O 271570a_100011290941_100010187912 [1,0,1,0,0,0|2,0,0]=4 594 B10R1.245 C=Cc1c(cccc1C)C 271570a_100011290941_100000033847 [1,0,1,0,0,0|1,0,0]=3 595 B10R1.245 C=Cc1c(cccc1Cl)C 271570a_100011290941_100000043165 [1,0,1,0,0,0|1,0,0]=3 596 B10R1.245 C=Cc1c(cccc1Cl)Cl 271570a_100011290941_100000034237 [1,0,1,0,0,0|2,0,0]=4 597 B10R1.245 C=Cc1c(cccc1Cl)F 271570a_100011290941_100000050007 [1,0,1,0,0,0|2,0,0]=4 598 B10R1.245 C=Cc1c(cccc1Cl)N 271570a_100011290941_100000049713 [1,0,1,0,0,0|1,0,1]=4 599 B10R1.245 C=Cc1c(cccc1Cl)O 271570a_100011290941_100000050174 [1,0,1,0,0,0|2,0,0]=4 600 B10R1.245 C=Cc1c(cccc1F)C 271570a_100011290941_100012349962 [1,0,1,0,0,0|1,0,0]=3 601 B10R1.245 C=Cc1c(cccc1F)F 271570a_100011290941_100000693133 [1,0,1,0,0,0|2,0,0]=4 602 B10R1.245 C=Cc1c(cccc1F)N 271570a_100011290941_100011934729 [1,0,1,0,0,0|1,0,1]=4 603 B10R1.245 C=Cc1c(cccc1F)O 271570a_100011290941_100009820682 [1,0,1,0,0,0|2,0,0]=4 604 B10R1.245 C=Cc1c(cccc1N)C 271570a_100011290941_100000684715 [1,0,1,0,0,0|0,0,1]=3 605 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [1,0,1,0,0,0|1,0,0]=3 606 B10R1.245 C=Cc1c(cccc1O)N 271570a_100011290941_100012183704 [1,0,1,0,0,0|1,0,1]=4 607 B10R1.245 C=Cc1c(cccc1O)O 271570a_100011290941_100010205330 [1,0,1,0,0,0|2,0,0]=4 608 B10R1.245 C=Cc1c(ccnc1C)C 271570a_100011290941_100012000501 [1,0,1,0,0,0|2,0,0]=4 609 B10R1.245 C=Cc1c(ccnc1C)N 271570a_100011290941_100010243816 [1,0,1,0,0,0|1,0,1]=4 610 B10R1.245 C=Cc1c(ccnc1F)C 271570a_100011290941_100009818256 [1,0,1,0,0,0|2,0,0]=4 611 B10R1.245 C=Cc1c(ccnc1N)C 271570a_100011290941_100011998619 [1,0,1,0,0,0|1,0,1]=4 612 B10R1.245 C=Cc1c(ccnc1O)C 271570a_100011290941_100012000493 [1,0,1,0,0,0|2,0,0]=4 613 B10R1.245 C=Cc1c(cncc1C)C 271570a_100011290941_100009817138 [1,0,1,0,0,0|2,0,0]=4 614 B10R1.245 Cc1cccc(c1C=O)O 271570a_203496583355_100000041122 [1,0,1,0,0,0|2,0,0]=4 615 B12R1.25 C=CCNc1cccc(c1Br)C 34a_100000684715_100015514636 [0,1,1,0,0,0|1,0,1]=4 616 B12R1.25 C=CCNc1cccc(c1C)C 2230a_100000210026_100000210623 [0,1,1,0,0,0|1,0,1]=4 617 B12R1.25 C=CCNc1cccc(c1C)C 34a_100000210026_100015514636 [0,1,1,0,0,0|1,0,1]=4 618 B12R1.25 C=CCNc1cccc(c1C)C 7a_100000210026_100015514636 [0,1,1,0,0,0|1,0,1]=4 619 B12R1.25 C=CCNc1cccc(c1Cl)C 34a_100000765562_100015514636 [0,1,1,0,0,0|1,0,1]=4 620 B12R1.25 C=CCNc1cccc(c1Cl)C 7a_100000765562_100015514636 [0,1,1,0,0,0|1,0,1]=4 621 B12R1.25 C=CCNc1cccc(c1F)C 2230a_100000697159_100000210623 [0,1,1,0,0,0|1,0,1]=4 622 B12R1.25 C=CCNc1cccc(c1F)C 34a_100000697159_100015514636 [0,1,1,0,0,0|1,0,1]=4 623 B12R1.25 C=CCNc1cccc(c1F)C 7a_100000697159_100015514636 [0,1,1,0,0,0|1,0,1]=4 624 B12R1.25 C=CCNc1cccc(c1I)C 34a_100000761888_100015514636 [0,1,1,0,0,0|1,0,1]=4 625 B12R1.25 C=CCNc1cccc(c1O)C 34a_100000756359_100015514636 [0,1,1,0,0,0|1,0,1]=4 626 B12R1.25 C=CCOc1cccc(c1Br)C 34a_100000686692_100015514636 [0,1,1,0,0,0|2,0,0]=4 627 B12R1.25 C=CCOc1cccc(c1Br)C 7a_100000686692_100015514636 [0,1,1,0,0,0|2,0,0]=4 628 B12R1.25 C=CCOc1cccc(c1C)C 34a_100000185855_100015514636 [0,1,1,0,0,0|2,0,0]=4 629 B12R1.25 C=CCOc1cccc(c1C)C 7a_100000185855_100015514636 [0,1,1,0,0,0|2,0,0]=4 630 B12R1.25 C=CCOc1cccc(c1Cl)C 34a_100000695629_100015514636 [0,1,1,0,0,0|2,0,0]=4 631 B12R1.25 C=CCOc1cccc(c1Cl)C 7a_100000695629_100015514636 [0,1,1,0,0,0|2,0,0]=4 632 B12R1.25 C=CCOc1cccc(c1F)C 34a_100000751311_100015514636 [0,1,1,0,0,0|2,0,0]=4 633 B12R1.25 C=CCOc1cccc(c1F)C 7a_100000751311_100015514636 [0,1,1,0,0,0|2,0,0]=4 634 B12R1.25 C=CCOc1cccc(c1I)C 34a_100010083724_100015514636 [0,1,1,0,0,0|2,0,0]=4 635 B12R1.25 C=CCOc1cccc(c1I)C 7a_100010083724_100015514636 [0,1,1,0,0,0|2,0,0]=4 636 B12R1.25 C=CCOc1cccc(c1N)C 34a_100000743429_100015514636 [0,1,1,0,0,0|1,0,1]=4 637 B12R1.25 C=CCOc1cccc(c1N)C 7a_100000743429_100015514636 [0,1,1,0,0,0|1,0,1]=4 638 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100000210623_100012362457 [0,1,1,0,0,0|2,0,0]=4 639 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100012362457_100000210623 [0,1,1,0,0,0|2,0,0]=4 640 B12R1.25 C=CCSc1cccc(c1C)C 62a_100000210623_100011214922 [0,1,1,0,0,0|2,0,0]=4 641 B12R1.25 C=CCSc1cccc(c1C)C 62a_100011214922_100000210623 [0,1,1,0,0,0|2,0,0]=4 642 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_100000210623_200012352035 [0,1,1,0,0,0|2,0,0]=4 643 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_200012352035_100000210623 [0,1,1,0,0,0|2,0,0]=4 644 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000210623_100000717567 [0,1,1,0,0,0|2,0,0]=4 645 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000717567_100000210623 [0,1,1,0,0,0|2,0,0]=4 646 B12R1.25 C=CCSc1cccc(c1N)C 62a_100000210623_100011834072 [0,1,1,0,0,0|1,0,1]=4 647 B12R1.25 C=CCSc1cccc(c1N)C 62a_100011834072_100000210623 [0,1,1,0,0,0|1,0,1]=4 648 B12R1.25 C=CCSc1cccc(c1O)C 62a_100000210623_100009817157 [0,1,1,0,0,0|2,0,0]=4 649 B12R1.25 C=CCSc1cccc(c1O)C 62a_100009817157_100000210623 [0,1,1,0,0,0|2,0,0]=4 650 B12R1.25 CC=NNc1cccc(c1C)C 4a_100020604495_200000210099 [0,1,1,0,0,0|1,0,1]=4 651 B12R1.542 C=CCc1cccc(c1OC)C 34a_200011218211_200000210301 [0,1,1,0,0,0|2,0,0]=4 652 B12R1.542 C=CCc1cccc(c1OC)C 7a_200011218211_200000210301 [0,1,1,0,0,0|2,0,0]=4 653 B12R1.542 C=CCc1cccc(c1O[13CH3])C 34a_200011218211_200025704644 [0,1,1,0,0,0|2,0,0]=4 654 B12R1.542 C=CCc1cccc(c1O[13CH3])C 7a_200011218211_200025704644 [0,1,1,0,0,0|2,0,0]=4 655 B12R1.30 C=CCCN(C)c1cnccn1 27a_100020639649_100000211759 [0,1,1,0,0,0|1,0,1]=4 656 B12R1.30 C=CCNC(C)c1cnccn1 2230a_100020586998_200000703233 [0,1,1,0,0,0|0,0,2]=4 657 B12R1.30 C=CCN[C@H](C)c1cnccn1 2230a_100020589798_100000210623 [0,1,1,0,0,0|0,0,2]=4 658 B12R1.30 C=CCSC(C)c1cnccn1 62a_100000210623_200000703233 [0,1,1,0,0,0|0,0,2]=4 659 B12R1.30 C=CCSC(C)c1cnccn1 62a_200000703233_100000210623 [0,1,1,0,0,0|0,0,2]=4 660 B12R1.34 C=CC(=O)C(C)c1cnccn1 1458a_100000185746_200000703233 [0,1,1,0,0,0|0,0,1]=3 661 B12R1.107 C=C(C)CN(C)c1cnccn1 27a_100000225649_100000211759 [0,1,1,0,0,0|1,0,1]=4 662 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200000210301_200016268969 [0,1,1,0,0,0|2,0,0]=4 663 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200016268969_200000210301 [0,1,1,0,0,0|2,0,0]=4 664 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200016268969_200025704644 [0,1,1,0,0,0|2,0,0]=4 665 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200025704644_200016268969 [0,1,1,0,0,0|2,0,0]=4 666 B12R1.267 C/C=C/CNc1ccccc1C 34a_100015192222_100102629194 [0,1,1,0,0,0|1,0,1]=4 667 B12R1.267 C/C=C/COc1ccccc1C 34a_100000210338_100102629194 [0,1,1,0,0,0|2,0,0]=4 668 B12R1.267 C/C=C/COc1ccccc1C 7a_100000210338_100102629194 [0,1,1,0,0,0|2,0,0]=4 669 B12R1.267 C/C=C/CSc1ccccc1C 62a_100000210755_100102629194 [0,1,1,0,0,0|2,0,0]=4 670 B12R1.267 C/C=C/CSc1ccccc1C 62a_100102629194_100000210755 [0,1,1,0,0,0|2,0,0]=4 671 B12R1.267 CC=CCNc1ccccc1C 34a_100015192222_100000070051 [0,1,1,0,0,0|1,0,1]=4 672 B12R1.267 CC=CCOc1ccccc1C 34a_100000210338_100000070051 [0,1,1,0,0,0|2,0,0]=4 673 B12R1.267 CC=CCOc1ccccc1C 7a_100000210338_100000070051 [0,1,1,0,0,0|2,0,0]=4 674 B12R1.267 CC=CCSc1ccccc1C 62a_100000070051_100000210755 [0,1,1,0,0,0|2,0,0]=4 675 B12R1.267 CC=CCSc1ccccc1C 62a_100000210755_100000070051 [0,1,1,0,0,0|2,0,0]=4 676 B12R1.267 CCC=NNc1ccccc1C 4a_100000184220_100000210100 [0,1,1,0,0,0|1,0,1]=4 677 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [0,1,1,0,0,0|2,0,0]=4 678 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [0,1,1,0,0,0|1,0,1]=4 679 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [0,1,1,0,0,0|1,0,1]=4 680 B12R1.28 C/C=C/CNc1cccc(c1)C 34a_100000188690_100102629194 [0,1,1,0,0,0|1,0,1]=4 681 B12R1.28 C/C=C/COc1cccc(c1)C 34a_100000210337_100102629194 [0,1,1,0,0,0|2,0,0]=4 682 B12R1.28 C/C=C/COc1cccc(c1)C 7a_100000210337_100102629194 [0,1,1,0,0,0|2,0,0]=4 683 B12R1.28 C/C=C/CSc1cccc(c1)C 62a_100011215228_100102629194 [0,1,1,0,0,0|2,0,0]=4 684 B12R1.28 C/C=C/CSc1cccc(c1)C 62a_100102629194_100011215228 [0,1,1,0,0,0|2,0,0]=4 685 B12R1.28 CC=CCNc1cccc(c1)C 2230a_100000188690_100000070051 [0,1,1,0,0,0|1,0,1]=4 686 B12R1.28 CC=CCNc1cccc(c1)C 34a_100000188690_100000070051 [0,1,1,0,0,0|1,0,1]=4 687 B12R1.28 CC=CCOc1cccc(c1)C 34a_100000210337_100000070051 [0,1,1,0,0,0|2,0,0]=4 688 B12R1.28 CC=CCOc1cccc(c1)C 7a_100000210337_100000070051 [0,1,1,0,0,0|2,0,0]=4 689 B12R1.28 CC=CCSc1cccc(c1)C 62a_100000070051_100011215228 [0,1,1,0,0,0|2,0,0]=4 690 B12R1.28 CC=CCSc1cccc(c1)C 62a_100011215228_100000070051 [0,1,1,0,0,0|2,0,0]=4 691 B12R1.28 CCC=NNc1cccc(c1)C 4a_100000681630_100000210100 [0,1,1,0,0,0|1,0,1]=4 692 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,1,1,0,0,0|2,0,0]=4 693 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,1,1,0,0,0|1,0,1]=4 694 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,1,1,0,0,0|1,0,1]=4 695 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,1,1,0,0,0|2,0,0]=4 696 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,1,1,0,0,0|2,0,0]=4 697 B12R1.1 C/C=C/COc1cnc(cn1)Br 34a_100011934580_100102629194 [0,1,1,0,0,0|1,0,1]=4 698 B12R1.1 C/C=C/COc1cnc(cn1)Cl 34a_100015839800_100102629194 [0,1,1,0,0,0|1,0,1]=4 699 B12R1.1 C/C=C/CSc1cnc(cn1)Br 62a_100010187541_100102629194 [0,1,1,0,0,0|1,0,1]=4 700 B12R1.1 C/C=C/CSc1cnc(cn1)Br 62a_100102629194_100010187541 [0,1,1,0,0,0|1,0,1]=4 701 B12R1.1 C/C=C/CSc1cnc(cn1)C 62a_100011999403_100102629194 [0,1,1,0,0,0|1,0,1]=4 702 B12R1.1 C/C=C/CSc1cnc(cn1)C 62a_100102629194_100011999403 [0,1,1,0,0,0|1,0,1]=4 703 B12R1.1 C/C=C/CSc1cnc(cn1)Cl 62a_100010214907_100102629194 [0,1,1,0,0,0|1,0,1]=4 704 B12R1.1 C/C=C/CSc1cnc(cn1)Cl 62a_100102629194_100010214907 [0,1,1,0,0,0|1,0,1]=4 705 B12R1.1 C/C=C/CSc1cnc(cn1)F 62a_100009856528_100102629194 [0,1,1,0,0,0|1,0,1]=4 706 B12R1.1 C/C=C/CSc1cnc(cn1)F 62a_100102629194_100009856528 [0,1,1,0,0,0|1,0,1]=4 707 B12R1.1 C/C=C/CSc1cnc(cn1)N 62a_100000744751_100102629194 [0,1,1,0,0,0|1,0,1]=4 708 B12R1.1 C/C=C/CSc1cnc(cn1)N 62a_100102629194_100000744751 [0,1,1,0,0,0|1,0,1]=4 709 B12R1.1 C/C=C/CSc1cnc(cn1)O 62a_100011934580_100102629194 [0,1,1,0,0,0|1,0,1]=4 710 B12R1.1 C/C=C/CSc1cnc(cn1)O 62a_100102629194_100015839800 [0,1,1,0,0,0|1,0,1]=4 711 B12R1.1 CC=CCOc1cnc(cn1)Br 34a_100011934580_100000070051 [0,1,1,0,0,0|1,0,1]=4 712 B12R1.1 CC=CCOc1cnc(cn1)Cl 34a_100015839800_100000070051 [0,1,1,0,0,0|1,0,1]=4 713 B12R1.1 CC=CCSc1cnc(cn1)Br 62a_100000070051_100010187541 [0,1,1,0,0,0|1,0,1]=4 714 B12R1.1 CC=CCSc1cnc(cn1)Br 62a_100010187541_100000070051 [0,1,1,0,0,0|1,0,1]=4 715 B12R1.1 CC=CCSc1cnc(cn1)C 62a_100000070051_100011999403 [0,1,1,0,0,0|1,0,1]=4 716 B12R1.1 CC=CCSc1cnc(cn1)C 62a_100011999403_100000070051 [0,1,1,0,0,0|1,0,1]=4 717 B12R1.1 CC=CCSc1cnc(cn1)Cl 62a_100000070051_100010214907 [0,1,1,0,0,0|1,0,1]=4 718 B12R1.1 CC=CCSc1cnc(cn1)Cl 62a_100010214907_100000070051 [0,1,1,0,0,0|1,0,1]=4 719 B12R1.1 CC=CCSc1cnc(cn1)F 62a_100000070051_100009856528 [0,1,1,0,0,0|1,0,1]=4 720 B12R1.1 CC=CCSc1cnc(cn1)F 62a_100009856528_100000070051 [0,1,1,0,0,0|1,0,1]=4 721 B12R1.1 CC=CCSc1cnc(cn1)N 62a_100000070051_100000744751 [0,1,1,0,0,0|1,0,1]=4 722 B12R1.1 CC=CCSc1cnc(cn1)N 62a_100000744751_100000070051 [0,1,1,0,0,0|1,0,1]=4 723 B12R1.1 CC=CCSc1cnc(cn1)O 62a_100000070051_100015839800 [0,1,1,0,0,0|1,0,1]=4 724 B12R1.1 CC=CCSc1cnc(cn1)O 62a_100011934580_100000070051 [0,1,1,0,0,0|1,0,1]=4 725 B12R1.1 CCCC=Cc1cnc(cn1)C 271570a_100016258520_100011999403 [0,1,1,0,0,0|0,0,2]=4 726 B12R1.1 CCCC=Cc1cnc(cn1)F 271570a_100016258520_100009856528 [0,1,1,0,0,0|0,0,2]=4 727 B12R1.1 CCCC=Cc1cnc(cn1)N 271570a_100016258520_100000761932 [0,1,1,0,0,0|0,0,2]=4 728 B12R1.1 CCOC=Cc1cnc(cn1)C 271570a_100016256518_100011999403 [0,1,1,0,0,0|1,0,1]=4 729 B12R1.1 CCOC=Cc1cnc(cn1)F 271570a_100016256518_100009856528 [0,1,1,0,0,0|1,0,1]=4 730 B12R1.1 CCOC=Cc1cnc(cn1)N 271570a_100016256518_100000761932 [0,1,1,0,0,0|1,0,1]=4 731 B12R1.1 COCC=Cc1cnc(cn1)C 271570a_100016286323_100011999403 [0,1,1,0,0,0|1,0,1]=4 732 B12R1.1 COCC=Cc1cnc(cn1)F 271570a_100016286323_100009856528 [0,1,1,0,0,0|1,0,1]=4 733 B12R1.1 COCC=Cc1cnc(cn1)N 271570a_100016286323_100000761932 [0,1,1,0,0,0|1,0,1]=4 734 B12R1.8 C/C=C/COCc1cnccn1 34a_100016270725_100016995436 [0,1,1,0,0,0|0,0,2]=4 735 B12R1.8 C/C=C/CSCc1cnccn1 62a_100016995436_100102629194 [0,1,1,0,0,0|0,0,2]=4 736 B12R1.8 C/C=C/CSCc1cnccn1 62a_100102629194_100016995436 [0,1,1,0,0,0|0,0,2]=4 737 B12R1.8 CC/C=C\CSc1cnccn1 62a_100000211759_100103147603 [0,1,1,0,0,0|0,0,2]=4 738 B12R1.8 CC/C=C\CSc1cnccn1 62a_100103147603_100000211759 [0,1,1,0,0,0|0,0,2]=4 739 B12R1.8 CC=CCSCc1cnccn1 62a_100000070051_100016995436 [0,1,1,0,0,0|0,0,2]=4 740 B12R1.8 CC=CCSCc1cnccn1 62a_100016995436_100000070051 [0,1,1,0,0,0|0,0,2]=4 741 B12R1.8 CCCCC=Cc1cnccn1 271570a_100016275911_100000758340 [0,1,1,0,0,0|0,0,2]=4 742 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [0,1,1,0,0,0|1,0,1]=4 743 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [0,1,1,0,0,0|1,0,1]=4 744 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [0,1,1,0,0,0|2,0,0]=4 745 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [0,1,1,0,0,0|2,0,0]=4 746 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [0,1,1,0,0,0|2,0,0]=4 747 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [0,1,1,0,0,0|2,0,0]=4 748 B12R1.32 CC=CC(=O)Cc1ccccn1 1458a_100000210699_100000721315 [0,1,1,0,0,0|1,0,1]=4 749 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,1,1,0,0,0|1,0,1]=4 750 B12R1.32 CC=CC(=O)Cc1cnccn1 1458a_100000210699_100016995436 [0,1,1,0,0,0|0,0,1]=3 751 B12R1.32 O=C(C=CBr)Cc1cnccn1 1458a_100016273825_100016995436 [0,1,1,0,0,0|1,0,1]=4 752 B12R1.32 O=C(C=CCl)Cc1cnccn1 1458a_200016279998_100016995436 [0,1,1,0,0,0|1,0,1]=4 753 B12R1.32 O=C(C=CI)Cc1cnccn1 1458a_100016256311_100016995436 [0,1,1,0,0,0|1,0,1]=4 754 B12R1.252 C=C(C)C=NNc1cnccn1 4a_100000736894_100000210575 [0,1,1,0,0,0|2,0,0]=4 755 B12R1.252 CC(=CCNc1cnccn1)C 27a_100000718196_100000211759 [0,1,1,0,0,0|1,0,1]=4 756 B12R1.252 CC(=CCSc1cnccn1)C 62a_100000211759_100000761012 [0,1,1,0,0,0|1,0,1]=4 757 B12R1.252 CC(=CCSc1cnccn1)C 62a_100000761012_100000211759 [0,1,1,0,0,0|1,0,1]=4 758 B12R1.252 CC(=O)NN=Cc1cnccn1 4a_100000189765_100000749867 [0,1,1,0,0,0|2,0,0]=4 759 B12R1.252 CC(C)CC=Cc1cnccn1 271570a_100016259101_100000758340 [0,1,1,0,0,0|0,0,2]=4 760 B12R1.75 CCc1nccnc1C=C(C)C 271570a_100102525489_100011995844 [0,1,1,0,0,0|0,0,2]=4 761 B12R1.75 CNc1nccnc1C=C(C)C 271570a_100102525489_100011529439 [0,1,1,0,0,0|1,0,1]=4 762 B12R1.75 COc1nccnc1C=C(C)C 271570a_100102525489_100000749998 [0,1,1,0,0,0|1,0,1]=4 763 B12R1.112 C=C=Cc1ncc(nc1OC)Br 271570a_100015277604_100010214903 [0,1,1,0,0,0|1,0,1]=4 764 B12R1.112 C=C=Cc1ncc(nc1OC)N 271570a_100015277604_100010128448 [0,1,1,0,0,0|1,0,1]=4 765 B12R1.112 CC=Cc1ncc(nc1OC)Br 271570a_100016259895_100010214903 [0,1,1,0,0,0|1,0,1]=4 766 B12R1.112 CC=Cc1ncc(nc1OC)N 271570a_100016259895_100010128448 [0,1,1,0,0,0|1,0,1]=4 767 B12R1.169 C=C=Cc1nccnc1OCC 271570a_100015277604_200010128176 [0,1,1,0,0,0|0,0,2]=4 768 B12R1.169 CC=Cc1nccnc1OCC 271570a_100016259895_200010128176 [0,1,1,0,0,0|0,0,2]=4 769 B12R1.283 C=C=Cc1cccnc1C(=O)C 271570a_100015277604_100012348690 [0,1,1,0,0,0|1,0,1]=4 770 B12R1.283 C=C=Cc1ncccc1C(=O)C 271570a_100015277604_100000753718 [0,1,1,0,0,0|1,0,1]=4 771 B12R1.283 C=C=Cc1nccnc1C(=O)C 271570a_100015277604_100000099859 [0,1,1,0,0,0|0,0,1]=3 772 B12R1.283 C=C=Cc1nccnc1C(=O)N 271570a_100015277604_100000094861 [0,1,1,0,0,0|1,0,1]=4 773 B12R1.283 C=C=Cc1nccnc1N(C)C 271570a_100015277604_100000703087 [0,1,1,0,0,0|1,0,1]=4 774 B12R1.283 CC=Cc1cccnc1C(=O)C 271570a_100016259895_100012348690 [0,1,1,0,0,0|1,0,1]=4 775 B12R1.283 CC=Cc1ncccc1C(=O)C 271570a_100016259895_100000753718 [0,1,1,0,0,0|1,0,1]=4 776 B12R1.283 CC=Cc1nccnc1C(=O)C 271570a_100016259895_100000099859 [0,1,1,0,0,0|0,0,1]=3 777 B12R1.283 CC=Cc1nccnc1C(=O)N 271570a_100016259895_100000094861 [0,1,1,0,0,0|1,0,1]=4 778 B12R1.283 CC=Cc1nccnc1N(C)C 271570a_100016259895_100000703087 [0,1,1,0,0,0|1,0,1]=4 779 B12R1.46 C=C(C)c1nc(ccc1C=O)C 271570a_100000694244_100000085379 [0,1,1,0,0,0|2,0,0]=4 780 B12R1.46 C=C(C)c1nc(ccc1C=O)F 271570a_100000694244_100009846357 [0,1,1,0,0,0|2,0,0]=4 781 B12R1.46 C=C(C)c1nc(cnc1C#N)N 271570a_100000694244_100000099870 [0,1,1,0,0,0|1,0,1]=4 782 B12R1.46 C=Cc1ncc(cc1C(=O)C)F 271570a_100011290941_100000118324 [0,1,1,0,0,0|2,0,0]=4 783 B12R1.57 C=C(C)c1ccc(nc1C=O)C 271570a_100000694244_100010173661 [0,1,1,0,0,0|2,0,0]=4 784 B12R1.57 C=C(C)c1ncc(cc1C=O)C 271570a_100000694244_100000050350 [0,1,1,0,0,0|2,0,0]=4 785 B12R1.57 C=C(C)c1ncc(cc1C=O)F 271570a_100000694244_100000079965 [0,1,1,0,0,0|2,0,0]=4 786 B12R1.57 C=C(C)c1ncc(nc1OC)Br 271570a_100000694244_100010214903 [0,1,1,0,0,0|1,0,1]=4 787 B12R1.57 C=C(C)c1ncc(nc1OC)N 271570a_100000694244_100010128448 [0,1,1,0,0,0|1,0,1]=4 788 B12R1.57 C=Cc1nc(cnc1C(C)C)C 271570a_100011290941_100015629263 [0,1,1,0,0,0|0,0,2]=4 789 B12R1.87 C=C(C)c1nccc(c1C=O)O 271570a_100000694244_200010729673 [0,1,1,0,0,0|2,0,0]=4 790 B12R1.261 C=C(C)c1cccnc1C(=O)C 271570a_100000694244_100012348690 [0,1,1,0,0,0|1,0,1]=4 791 B12R1.261 C=C(C)c1cccnc1C(=O)N 271570a_100000694244_200012359670 [0,1,1,0,0,0|2,0,0]=4 792 B12R1.261 C=C(C)c1ncccc1C(=O)C 271570a_100000694244_100000753718 [0,1,1,0,0,0|1,0,1]=4 793 B12R1.261 C=C(C)c1ncccc1C(=O)N 271570a_100000694244_100000162199 [0,1,1,0,0,0|2,0,0]=4 794 B12R1.261 C=C(C)c1nccnc1C(=O)C 271570a_100000694244_100000099859 [0,1,1,0,0,0|0,0,1]=3 795 B12R1.261 C=C(C)c1nccnc1C(=O)N 271570a_100000694244_100000094861 [0,1,1,0,0,0|1,0,0]=3 796 B12R1.261 C=C(C)c1nccnc1N(C)C 271570a_100000694244_100000703087 [0,1,1,0,0,0|1,0,1]=4 797 B12R1.437 C=Cc1nccc(c1C(=O)C)N 271570a_100011290941_200010729368 [0,1,1,0,0,0|2,0,0]=4 798 B12R1.124 CC(=C(C)c1nccnc1C)C 271570a_200000049429_100011999405 [0,1,1,0,0,0|0,0,2]=4 799 B12R1.124 CC(=C(C)c1nccnc1F)C 271570a_200000049429_200010125657 [0,1,1,0,0,0|1,0,1]=4 800 B12R1.124 CC(=C(C)c1nccnc1N)C 271570a_200000049429_100000747729 [0,1,1,0,0,0|1,0,1]=4 801 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [1,1,0,0,0,0|1,0,0]=3 802 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [1,1,0,0,0,0|2,0,0]=4 803 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [1,1,0,0,0,0|1,0,0]=3 804 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [1,1,0,0,0,0|1,0,0]=3 805 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [1,1,0,0,0,0|2,0,0]=4 806 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [1,1,0,0,0,0|2,0,0]=4 807 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [1,1,0,0,0,0|2,0,0]=4 808 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [1,1,0,0,0,0|1,0,0]=3 809 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [1,1,0,0,0,0|2,0,0]=4 810 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [1,1,0,0,0,0|0,0,0]=2 811 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [1,1,0,0,0,0|1,0,0]=3 812 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [1,1,0,0,0,0|2,0,0]=4 813 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [1,1,0,0,0,0|2,0,0]=4 814 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [1,1,0,0,0,0|1,0,0]=3 815 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [1,1,0,0,0,0|0,0,0]=2 816 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [1,1,0,0,0,0|2,0,0]=4 817 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [1,1,0,0,0,0|1,0,0]=3 818 B12R2.24 Oc1cnc2nccnc2c1 271570a_203496583355_100000753224 [1,1,0,0,0,0|1,0,0]=3 819 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [1,1,0,0,0,0|2,0,0]=4 820 B12R2.1 C=Cc1csc2c1nccn2 271570a_100011290941_100010174841 [0,1,0,0,1,0|1,0,1]=4 821 B12R2.1 CNc1csc2c1nccn2 27a_100102657272_100010174841 [0,1,0,0,1,0|1,0,0]=3 822 B12R2.1 CNc1n[nH]c2c1nccn2 27a_100102657272_100009819591 [0,1,0,0,1,0|2,0,0]=4 823 B12R2.1 CSc1c[nH]c2c1cccn2 62a_200000210301_100011934613 [0,1,0,0,1,0|2,0,0]=4 824 B12R2.1 CSc1c[nH]c2c1nccc2 62a_200000210301_100009817151 [0,1,0,0,1,0|2,0,0]=4 825 B12R2.1 CSc1c[nH]c2c1nccn2 62a_200000210301_100009819587 [0,1,0,0,1,0|1,0,0]=3 826 B12R2.1 CSc1coc2c1nccc2 62a_200000210301_100009889148 [0,1,0,0,1,0|2,0,0]=4 827 B12R2.1 CSc1csc2c1cccn2 62a_100009830249_200000210301 [0,1,0,0,1,0|2,0,0]=4 828 B12R2.1 CSc1csc2c1cccn2 62a_200000210301_100009830249 [0,1,0,0,1,0|2,0,0]=4 829 B12R2.1 CSc1csc2c1nccc2 62a_200000210301_100010247092 [0,1,0,0,1,0|2,0,0]=4 830 B12R2.1 CSc1csc2c1nccn2 62a_200000210301_100010174841 [0,1,0,0,1,0|1,0,0]=3 831 B12R2.1 CSc1n[nH]c2c1nccn2 62a_200000210301_100009819591 [0,1,0,0,1,0|2,0,0]=4 832 B12R2.1 [13CH3]Sc1c[nH]c2c1cccn2 62a_200025704644_100011934613 [0,1,0,0,1,0|2,0,0]=4 833 B12R2.1 [13CH3]Sc1c[nH]c2c1nccc2 62a_200025704644_100009817151 [0,1,0,0,1,0|2,0,0]=4 834 B12R2.1 [13CH3]Sc1c[nH]c2c1nccn2 62a_200025704644_100009819587 [0,1,0,0,1,0|1,0,0]=3 835 B12R2.1 [13CH3]Sc1coc2c1nccc2 62a_200025704644_100009889148 [0,1,0,0,1,0|2,0,0]=4 836 B12R2.1 [13CH3]Sc1csc2c1cccn2 62a_100009830249_200025704644 [0,1,0,0,1,0|2,0,0]=4 837 B12R2.1 [13CH3]Sc1csc2c1cccn2 62a_200025704644_100009830249 [0,1,0,0,1,0|2,0,0]=4 838 B12R2.1 [13CH3]Sc1csc2c1nccc2 62a_200025704644_100010247092 [0,1,0,0,1,0|2,0,0]=4 839 B12R2.1 [13CH3]Sc1csc2c1nccn2 62a_200025704644_100010174841 [0,1,0,0,1,0|1,0,0]=3 840 B12R2.1 [13CH3]Sc1n[nH]c2c1nccn2 62a_200025704644_100009819591 [0,1,0,0,1,0|2,0,0]=4 841 B12R2.132 Cc1c[nH]c2c1cc(cn2)O 271570a_203496583355_100010202333 [0,1,0,0,1,0|2,0,0]=4 842 B12R2.132 Cn1ccc2c1cc(cn2)O 271570a_203496583355_100010761474 [0,1,0,0,1,0|2,0,0]=4 843 B12R2.196 Cn1ccc2c1nccc2O 271570a_203496583355_100010168893 [0,1,0,0,1,0|2,0,0]=4 844 B12R2.203 Cc1c[nH]c2c1c(ccn2)O 271570a_203496583355_100009849662 [0,1,0,0,1,0|2,0,0]=4 845 B12R2.612 Cn1ccc2c1ncc(c2)O 271570a_203496583355_100010191616 [0,1,0,0,1,0|2,0,0]=4 846 B12R2.612 Cn1ccc2c1ncc(n2)O 271570a_203496583355_100010168881 [0,1,0,0,1,0|1,0,0]=3 847 B12R2.2028 Cn1cc(c2c1nccc2)O 271570a_203496583355_100010205794 [0,1,0,0,1,0|2,0,0]=4 848 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,1,0,0,1,0|0,0,1]=3 849 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [0,1,0,0,1,0|0,0,1]=3 850 B12R2.82 Cc1c(ccc2c1cn[nH]2)O 271570a_203496583355_100009817094 [0,1,0,0,1,0|1,0,1]=4 851 B12R2.82 Cc1c(ccc2c1nc[nH]2)O 271570a_203496583355_100010009745 [0,1,0,0,1,0|0,0,1]=3 852 B12R2.82 Cc1c(ccc2n1ccn2)O 271570a_203496583355_100012569086 [0,1,0,0,1,0|1,0,0]=3 853 B12R2.82 Cc1c(ccc2n1cnn2)O 271570a_203496583355_200010371128 [0,1,0,0,1,0|2,0,0]=4 854 B12R2.82 Cc1c(ccc2n1ncc2)O 271570a_203496583355_100010767214 [0,1,0,0,1,0|1,0,0]=3 855 B12R2.82 Cc1c(ccc2n1ncn2)O 271570a_203496583355_100010201169 [0,1,0,0,1,0|1,0,0]=3 856 B12R2.82 Cc1c(cnc2c1[nH]cn2)O 271570a_203496583355_100010140963 [0,1,0,0,1,0|1,0,1]=4 857 B12R2.82 Cc1c(cnc2c1cc[nH]2)O 271570a_203496583355_100010254266 [0,1,0,0,1,0|1,0,1]=4 858 B12R2.82 Cc1c(ncc2c1[nH]cc2)O 271570a_203496583355_100010244392 [0,1,0,0,1,0|1,0,1]=4 859 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,1,0,0,1,0|1,0,1]=4 860 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,1,0,0,1,0|1,0,1]=4 861 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [0,1,0,0,1,0|2,0,0]=4 862 B12R2.82 Nc1c(ccc2c1scn2)O 271570a_203496583355_100010998030 [0,1,0,0,1,0|2,0,0]=4 863 B12R2.82 Nc1ccc2[nH]cnc2c1O 271570a_203496583355_100009816657 [0,1,0,0,1,0|1,0,1]=4 864 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,1,0,0,1,0|2,0,0]=4 865 B12R2.82 Nc1ccc2scnc2c1O 271570a_203496583355_100009816736 [0,1,0,0,1,0|2,0,0]=4 866 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,1,0,0,1,0|1,0,1]=4 867 B12R2.82 Oc1c(ccc2c1nc[nH]2)F 271570a_203496583355_200010369618 [0,1,0,0,1,0|1,0,1]=4 868 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,1,0,0,1,0|2,0,0]=4 869 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [0,1,0,0,1,0|1,0,1]=4 870 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,1,0|2,0,0]=4 871 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,1,0|1,0,1]=4 872 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,1,0,0,1,0|1,0,0]=3 873 B12R2.202 Cc1cn2c(cccc2n1)O 271570a_203496583355_100009817088 [0,1,0,0,1,0|2,0,0]=4 874 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,0,1,0|1,0,1]=4 875 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,0,1,0|2,0,0]=4 876 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,0,1,0|2,0,0]=4 877 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,0,1,0|2,0,0]=4 878 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,0,1,0|2,0,0]=4 879 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,1,0,0,1,0|2,0,0]=4 880 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,0,1,0|2,0,0]=4 881 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,0,1,0|2,0,0]=4 882 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,0,1,0|1,0,1]=4 883 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,1,0,0,1,0|2,0,0]=4 884 B12R2.202 Nc1nc2c(cccn2n1)O 271570a_203496583355_100012344205 [0,1,0,0,1,0|2,0,0]=4 885 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,1,0,0,1,0|2,0,0]=4 886 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,1,0,0,1,0|2,0,0]=4 887 B12R2.202 Nc1nc2cccc(n2n1)O 271570a_203496583355_100010243777 [0,1,0,0,1,0|2,0,0]=4 888 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,0,1,0|1,0,1]=4 889 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,0,1,0|1,0,1]=4 890 B12R2.202 Oc1nc2c(cccc2s1)F 271570a_203496583355_100010008856 [0,1,0,0,1,0|2,0,0]=4 891 B12R2.221 Cc1ccc(c2c1[nH]cc2)O 271570a_203496583355_100009820812 [0,1,0,0,1,0|0,0,1]=3 892 B12R2.221 Cc1ccc(c2c1[nH]nc2)O 271570a_203496583355_100009817120 [0,1,0,0,1,0|1,0,1]=4 893 B12R2.221 Cc1ccc(c2c1cc[nH]2)O 271570a_203496583355_100010219157 [0,1,0,0,1,0|0,0,1]=3 894 B12R2.221 Cc1ccc(c2c1cco2)O 271570a_203496583355_100010253976 [0,1,0,0,1,0|1,0,0]=3 895 B12R2.221 Cc1ccc(c2c1nsn2)O 271570a_203496583355_100010200902 [0,1,0,0,1,0|1,0,0]=3 896 B12R2.221 Cc1ccc(c2n1ccn2)O 271570a_203496583355_200015695500 [0,1,0,0,1,0|1,0,0]=3 897 B12R2.221 Cc1ccc(c2n1ncn2)O 271570a_203496583355_100010254782 [0,1,0,0,1,0|1,0,0]=3 898 B12R2.221 Cc1cnc(c2c1[nH]cc2)O 271570a_203496583355_100010244391 [0,1,0,0,1,0|1,0,1]=4 899 B12R2.221 Cc1ncc(c2c1cc[nH]2)O 271570a_203496583355_100010244396 [0,1,0,0,1,0|1,0,1]=4 900 B12R2.221 Oc1ccc(c2c1[nH]cc2)F 271570a_203496583355_100010138378 [0,1,0,0,1,0|1,0,1]=4 901 B12R2.221 Oc1ccc(c2c1cc[nH]2)F 271570a_203496583355_100010006601 [0,1,0,0,1,0|1,0,1]=4 902 B12R2.221 Oc1ccc(c2c1cco2)F 271570a_203496583355_100010248603 [0,1,0,0,1,0|2,0,0]=4 903 B12R2.221 Oc1ccc(c2c1cco2)O 271570a_203496583355_200020711608 [0,1,0,0,1,0|2,0,0]=4 904 B12R2.221 Oc1ccc(c2c1occ2)F 271570a_203496583355_100012355473 [0,1,0,0,1,0|2,0,0]=4 905 B12R2.221 Oc1ccc(n2c1ncc2)Cl 271570a_203496583355_100010184985 [0,1,0,0,1,0|2,0,0]=4 906 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [0,1,0,0,1,0|1,0,1]=4 907 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [0,1,0,0,1,0|1,0,1]=4 908 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [0,1,0,0,1,0|2,0,0]=4 909 B12R2.246 Cc1cc(c2ncnn2c1)O 271570a_203496583355_100009817174 [0,1,0,0,1,0|2,0,0]=4 910 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [0,1,0,0,1,0|2,0,0]=4 911 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [0,1,0,0,1,0|0,0,1]=3 912 B12R2.246 Cc1cc(cc2c1[nH]nc2)O 271570a_203496583355_100009812868 [0,1,0,0,1,0|1,0,1]=4 913 B12R2.246 Cc1cc(cc2c1cn[nH]2)O 271570a_203496583355_100009816875 [0,1,0,0,1,0|1,0,1]=4 914 B12R2.246 Cc1cc(cc2c1nc[nH]2)O 271570a_203496583355_100000239325 [0,1,0,0,1,0|0,0,1]=3 915 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [0,1,0,0,1,0|1,0,0]=3 916 B12R2.246 Cc1cc(cn2c1ncc2)O 271570a_203496583355_100000701042 [0,1,0,0,1,0|1,0,0]=3 917 B12R2.246 Cc1cc(cn2c1ncn2)O 271570a_203496583355_100010201170 [0,1,0,0,1,0|1,0,0]=3 918 B12R2.246 Cc1cc(cn2c1nnc2)O 271570a_203496583355_100010183136 [0,1,0,0,1,0|2,0,0]=4 919 B12R2.246 Cc1nc(cn2c1ncc2)O 271570a_203496583355_100010255711 [0,1,0,0,1,0|2,0,0]=4 920 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [0,1,0,0,1,0|1,0,1]=4 921 B12R2.246 Nc1cc(c2scnc2c1)O 271570a_203496583355_200010333430 [0,1,0,0,1,0|2,0,0]=4 922 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [0,1,0,0,1,0|1,0,1]=4 923 B12R2.246 Nc1cc(cc2c1cc[nH]2)O 271570a_203496583355_106744500199 [0,1,0,0,1,0|1,0,1]=4 924 B12R2.246 Nc1cc(cn2c1ncc2)O 271570a_203496583355_100009816852 [0,1,0,0,1,0|2,0,0]=4 925 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [0,1,0,0,1,0|1,0,1]=4 926 B12R2.246 Oc1cc(c2cc[nH]c2c1)Br 271570a_203496583355_100009814775 [0,1,0,0,1,0|1,0,1]=4 927 B12R2.246 Oc1cc(c2cc[nH]c2c1)F 271570a_203496583355_100010186028 [0,1,0,0,1,0|1,0,1]=4 928 B12R2.246 Oc1cc(c2nccn2c1)F 271570a_203496583355_100010174814 [0,1,0,0,1,0|2,0,0]=4 929 B12R2.246 Oc1cc(c2nccn2c1)O 271570a_203496583355_100010074634 [0,1,0,0,1,0|2,0,0]=4 930 B12R2.246 Oc1cc(c2ncnn2c1)F 271570a_203496583355_100015548010 [0,1,0,0,1,0|2,0,0]=4 931 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [0,1,0,0,1,0|2,0,0]=4 932 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,0,1,0|2,0,0]=4 933 B12R2.246 Oc1cc(cc2c1[nH]cc2)F 271570a_203496583355_100010138379 [0,1,0,0,1,0|1,0,1]=4 934 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [0,1,0,0,1,0|1,0,1]=4 935 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [0,1,0,0,1,0|1,0,1]=4 936 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [0,1,0,0,1,0|1,0,1]=4 937 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [0,1,0,0,1,0|2,0,0]=4 938 B12R2.246 Oc1cc(cc2c1occ2)F 271570a_203496583355_100011935139 [0,1,0,0,1,0|2,0,0]=4 939 B12R2.246 Oc1cc(cn2c1ncc2)Br 271570a_203496583355_100000687079 [0,1,0,0,1,0|2,0,0]=4 940 B12R2.246 Oc1cc(cn2c1ncc2)Cl 271570a_203496583355_100010232167 [0,1,0,0,1,0|2,0,0]=4 941 B12R2.246 Oc1cc(cn2c1ncc2)F 271570a_203496583355_100010289905 [0,1,0,0,1,0|2,0,0]=4 942 B12R2.246 Oc1cc(cn2c1ncn2)Cl 271570a_203496583355_100011099881 [0,1,0,0,1,0|2,0,0]=4 943 B12R2.315 C=Cc1cccc2c1CC=C2 271570a_100011290941_100009844718 [0,1,0,0,1,0|1,0,1]=4 944 B12R2.315 C=Cc1cccc2c1[nH]cc2 271570a_100011290941_100009813418 [0,1,0,0,1,0|0,0,2]=4 945 B12R2.315 C=Cc1cccc2c1cc[nH]2 271570a_100011290941_100000685724 [0,1,0,0,1,0|0,0,2]=4 946 B12R2.315 C=Cc1cccc2c1cco2 271570a_100011290941_100000756496 [0,1,0,0,1,0|1,0,1]=4 947 B12R2.315 C=Cc1cccc2c1ccs2 271570a_100011290941_100009816950 [0,1,0,0,1,0|1,0,1]=4 948 B12R2.315 C=Cc1cccc2c1nc[nH]2 271570a_100011290941_100011935113 [0,1,0,0,1,0|0,0,2]=4 949 B12R2.315 C=Cc1cccc2c1nco2 271570a_100011290941_100009816834 [0,1,0,0,1,0|1,0,1]=4 950 B12R2.315 C=Cc1cccc2c1ncs2 271570a_100011290941_100000726125 [0,1,0,0,1,0|1,0,1]=4 951 B12R2.315 C=Cc1cccc2c1non2 271570a_100011290941_100009820244 [0,1,0,0,1,0|1,0,1]=4 952 B12R2.315 C=Cc1cccc2c1nsn2 271570a_100011290941_100000742359 [0,1,0,0,1,0|1,0,1]=4 953 B12R2.315 C=Cc1cccc2c1occ2 271570a_100011290941_100011935138 [0,1,0,0,1,0|1,0,1]=4 954 B12R2.315 C=Cc1cccc2c1ocn2 271570a_100011290941_100000728214 [0,1,0,0,1,0|1,0,1]=4 955 B12R2.315 C=Cc1cccc2c1scc2 271570a_100011290941_100000766737 [0,1,0,0,1,0|1,0,1]=4 956 B12R2.315 C=Cc1cccc2c1scn2 271570a_100011290941_100010246326 [0,1,0,0,1,0|1,0,1]=4 957 B12R2.315 C=Cc1cccc2n1ccn2 271570a_100011290941_100000762677 [0,1,0,0,1,0|1,0,1]=4 958 B12R2.315 C=Cc1cccc2n1ncc2 271570a_100011290941_100009817731 [0,1,0,0,1,0|1,0,1]=4 959 B12R2.315 C=Cc1cccc2n1ncn2 271570a_100011290941_100009819724 [0,1,0,0,1,0|1,0,1]=4 960 B12R2.315 C=Cc1cccn2c1ccn2 271570a_100011290941_100010767162 [0,1,0,0,1,0|1,0,1]=4 961 B12R2.315 C=Cc1cccn2c1ncc2 271570a_100011290941_100011934911 [0,1,0,0,1,0|1,0,1]=4 962 B12R2.315 C=Cc1cccn2c1ncn2 271570a_100011290941_100009819722 [0,1,0,0,1,0|1,0,1]=4 963 B12R2.315 CNc1cc[nH]c-2nncc12 27a_100102657272_100015363004 [0,1,0,0,1,0|2,0,0]=4 964 B12R2.315 CNc1cccc2c1ccs2 34a_100020628958_200000210301 [0,1,0,0,1,0|1,0,0]=3 965 B12R2.315 CNc1cccc2c1nco2 34a_100000717946_200000210301 [0,1,0,0,1,0|1,0,0]=3 966 B12R2.315 CNc1cccc2c1non2 27a_100102657272_100009820244 [0,1,0,0,1,0|1,0,0]=3 967 B12R2.315 CNc1cccc2c1nsn2 27a_100102657272_100000742359 [0,1,0,0,1,0|1,0,0]=3 968 B12R2.315 CNc1cccc2c1scn2 34a_100000099145_200000210301 [0,1,0,0,1,0|1,0,0]=3 969 B12R2.315 CNc1cccc2n1cnn2 27a_100102657272_100009819885 [0,1,0,0,1,0|2,0,0]=4 970 B12R2.315 CNc1cccc2n1ncn2 27a_100102657272_100009819724 [0,1,0,0,1,0|1,0,0]=3 971 B12R2.315 CNc1cccn2c1ccn2 27a_100102657272_100010767162 [0,1,0,0,1,0|1,0,0]=3 972 B12R2.315 CNc1cccn2c1ncn2 27a_100102657272_100009819722 [0,1,0,0,1,0|1,0,0]=3 973 B12R2.315 CNc1ccnc2c1ccs2 27a_100102657272_100009861243 [0,1,0,0,1,0|2,0,0]=4 974 B12R2.315 CNc1ccnc2c1nc[nH]2 27a_100102657272_100009820729 [0,1,0,0,1,0|1,0,1]=4 975 B12R2.315 CNc1ccnc2c1scc2 27a_100102657272_100000764135 [0,1,0,0,1,0|2,0,0]=4 976 B12R2.315 CNc1ccnc2n1ncc2 27a_100102657272_100000080991 [0,1,0,0,1,0|2,0,0]=4 977 B12R2.315 CNc1cncc2n1ccn2 27a_100102657272_100009818520 [0,1,0,0,1,0|2,0,0]=4 978 B12R2.315 CNc1nc[nH]c-2nccc12 27a_100102657272_100015350423 [0,1,0,0,1,0|2,0,0]=4 979 B12R2.315 CNc1nccc2c1c[nH]n2 27a_100102657272_100020876377 [0,1,0,0,1,0|2,0,0]=4 980 B12R2.315 CNc1nccc2c1cco2 27a_100102657272_100000041166 [0,1,0,0,1,0|2,0,0]=4 981 B12R2.315 CNc1nccc2c1ccs2 27a_100102657272_100000047778 [0,1,0,0,1,0|2,0,0]=4 982 B12R2.315 CNc1nccc2c1scc2 27a_100102657272_100000117209 [0,1,0,0,1,0|2,0,0]=4 983 B12R2.315 CNc1nccn2c1ccn2 27a_100102657272_100009846796 [0,1,0,0,1,0|2,0,0]=4 984 B12R2.315 CNc1nccn2c1ncc2 27a_100102657272_102495338505 [0,1,0,0,1,0|2,0,0]=4 985 B12R2.315 CNc1nccn2c1ncn2 27a_100102657272_100000094309 [0,1,0,0,1,0|2,0,0]=4 986 B12R2.315 COc1cccc2c1cc[nH]2 34a_100000763377_200000210301 [0,1,0,0,1,0|0,0,1]=3 987 B12R2.315 COc1cccc2c1ccs2 34a_100000077759_200000210301 [0,1,0,0,1,0|1,0,0]=3 988 B12R2.315 COc1cccc2c1ccs2 7a_100000077759_200000210301 [0,1,0,0,1,0|1,0,0]=3 989 B12R2.315 COc1cccc2c1ncs2 34a_100000101385_200000210301 [0,1,0,0,1,0|1,0,0]=3 990 B12R2.315 COc1cccc2c1ncs2 7a_100000101385_200000210301 [0,1,0,0,1,0|1,0,0]=3 991 B12R2.315 COc1cccn2c1ncc2 34a_100000068405_200000210301 [0,1,0,0,1,0|1,0,0]=3 992 B12R2.315 COc1cccn2c1ncc2 7a_100000068405_200000210301 [0,1,0,0,1,0|1,0,0]=3 993 B12R2.315 COc1ccnc2c1scc2 34a_100000759877_200000210301 [0,1,0,0,1,0|2,0,0]=4 994 B12R2.315 CSc1cc[nH]c-2nncc12 62a_200000210301_100015363004 [0,1,0,0,1,0|2,0,0]=4 995 B12R2.315 CSc1cccc2c1CC=C2 62a_100009844718_200000210301 [0,1,0,0,1,0|1,0,0]=3 996 B12R2.315 CSc1cccc2c1CC=C2 62a_200000210301_100009844718 [0,1,0,0,1,0|1,0,0]=3 997 B12R2.315 CSc1cccc2c1[nH]cc2 62a_200000210301_100009813418 [0,1,0,0,1,0|0,0,1]=3 998 B12R2.315 CSc1cccc2c1[nH]nc2 62a_200000210301_100009816125 [0,1,0,0,1,0|1,0,1]=4 999 B12R2.315 CSc1cccc2c1[nH]nn2 62a_200000210301_100009820029 [0,1,0,0,1,0|1,0,1]=4 1000 B12R2.315 CSc1cccc2c1cc[nH]2 62a_200000210301_100000685724 [0,1,0,0,1,0|0,0,1]=3 1001 B12R2.315 CSc1cccc2c1cco2 62a_200000210301_100000756496 [0,1,0,0,1,0|1,0,0]=3 1002 B12R2.315 CSc1cccc2c1ccs2 62a_200000210301_100009816950 [0,1,0,0,1,0|1,0,0]=3 1003 B12R2.315 CSc1cccc2c1cn[nH]2 62a_200000210301_100000753301 [0,1,0,0,1,0|1,0,1]=4 1004 B12R2.315 CSc1cccc2c1cno2 62a_200000210301_100009818589 [0,1,0,0,1,0|2,0,0]=4 1005 B12R2.315 CSc1cccc2c1nc[nH]2 62a_200000210301_100011935113 [0,1,0,0,1,0|0,0,1]=3 1006 B12R2.315 CSc1cccc2c1nco2 62a_200000210301_100009816834 [0,1,0,0,1,0|1,0,0]=3 1007 B12R2.315 CSc1cccc2c1ncs2 62a_200000210301_100000726125 [0,1,0,0,1,0|1,0,0]=3 1008 B12R2.315 CSc1cccc2c1non2 62a_100009820244_200000210301 [0,1,0,0,1,0|1,0,0]=3 1009 B12R2.315 CSc1cccc2c1non2 62a_200000210301_100009820244 [0,1,0,0,1,0|1,0,0]=3 1010 B12R2.315 CSc1cccc2c1nsn2 62a_200000210301_100000742359 [0,1,0,0,1,0|1,0,0]=3 1011 B12R2.315 CSc1cccc2c1occ2 62a_200000210301_100011935138 [0,1,0,0,1,0|1,0,0]=3 1012 B12R2.315 CSc1cccc2c1ocn2 62a_200000210301_100000728214 [0,1,0,0,1,0|1,0,0]=3 1013 B12R2.315 CSc1cccc2c1onc2 62a_200000210301_100000765530 [0,1,0,0,1,0|2,0,0]=4 1014 B12R2.315 CSc1cccc2c1scc2 62a_200000210301_100000766737 [0,1,0,0,1,0|1,0,0]=3 1015 B12R2.315 CSc1cccc2c1scn2 62a_200000210301_100010246326 [0,1,0,0,1,0|1,0,0]=3 1016 B12R2.315 CSc1cccc2n1ccn2 62a_100000762677_200000210301 [0,1,0,0,1,0|1,0,0]=3 1017 B12R2.315 CSc1cccc2n1ccn2 62a_200000210301_100000762677 [0,1,0,0,1,0|1,0,0]=3 1018 B12R2.315 CSc1cccc2n1cnn2 62a_100009819885_200000210301 [0,1,0,0,1,0|2,0,0]=4 1019 B12R2.315 CSc1cccc2n1cnn2 62a_200000210301_100009819885 [0,1,0,0,1,0|2,0,0]=4 1020 B12R2.315 CSc1cccc2n1ncc2 62a_200000210301_100009817731 [0,1,0,0,1,0|1,0,0]=3 1021 B12R2.315 CSc1cccc2n1ncn2 62a_200000210301_100009819724 [0,1,0,0,1,0|1,0,0]=3 1022 B12R2.315 CSc1cccn2c1ccn2 62a_200000210301_100010767162 [0,1,0,0,1,0|1,0,0]=3 1023 B12R2.315 CSc1cccn2c1ncc2 62a_200000210301_100011934911 [0,1,0,0,1,0|1,0,0]=3 1024 B12R2.315 CSc1cccn2c1ncn2 62a_200000210301_100009819722 [0,1,0,0,1,0|1,0,0]=3 1025 B12R2.315 CSc1cccn2c1nnc2 62a_200000210301_100000764285 [0,1,0,0,1,0|2,0,0]=4 1026 B12R2.315 CSc1cccn2c1nnn2 62a_200000210301_100009852330 [0,1,0,0,1,0|2,0,0]=4 1027 B12R2.315 CSc1ccnc2c1[nH]cc2 62a_200000210301_100000087553 [0,1,0,0,1,0|1,0,1]=4 1028 B12R2.315 CSc1ccnc2c1cc[nH]2 62a_200000210301_100000766882 [0,1,0,0,1,0|1,0,1]=4 1029 B12R2.315 CSc1ccnc2c1ccs2 62a_200000210301_100009861243 [0,1,0,0,1,0|2,0,0]=4 1030 B12R2.315 CSc1ccnc2c1nc[nH]2 62a_200000210301_100009820729 [0,1,0,0,1,0|1,0,1]=4 1031 B12R2.315 CSc1ccnc2c1occ2 62a_200000210301_100009853057 [0,1,0,0,1,0|2,0,0]=4 1032 B12R2.315 CSc1ccnc2c1scc2 62a_200000210301_100000764135 [0,1,0,0,1,0|2,0,0]=4 1033 B12R2.315 CSc1ccnc2n1ncc2 62a_200000210301_100000080991 [0,1,0,0,1,0|2,0,0]=4 1034 B12R2.315 CSc1cncc2c1[nH]cc2 62a_200000210301_100000217057 [0,1,0,0,1,0|1,0,1]=4 1035 B12R2.315 CSc1cncc2c1[nH]cn2 62a_200000210301_100000759552 [0,1,0,0,1,0|1,0,1]=4 1036 B12R2.315 CSc1cncc2c1cc[nH]2 62a_200000210301_100009840476 [0,1,0,0,1,0|1,0,1]=4 1037 B12R2.315 CSc1cncc2n1ccn2 62a_100009818520_200000210301 [0,1,0,0,1,0|2,0,0]=4 1038 B12R2.315 CSc1cncc2n1ccn2 62a_200000210301_100009818520 [0,1,0,0,1,0|2,0,0]=4 1039 B12R2.315 CSc1nc[nH]c-2nccc12 62a_200000210301_100015350423 [0,1,0,0,1,0|2,0,0]=4 1040 B12R2.315 CSc1nccc2c1[nH]cc2 62a_200000210301_100000060748 [0,1,0,0,1,0|1,0,1]=4 1041 B12R2.315 CSc1nccc2c1c[nH]n2 62a_200000210301_100020876377 [0,1,0,0,1,0|2,0,0]=4 1042 B12R2.315 CSc1nccc2c1cc[nH]2 62a_200000210301_100000086534 [0,1,0,0,1,0|1,0,1]=4 1043 B12R2.315 CSc1nccc2c1cco2 62a_200000210301_100000041166 [0,1,0,0,1,0|2,0,0]=4 1044 B12R2.315 CSc1nccc2c1ccs2 62a_200000210301_100000047778 [0,1,0,0,1,0|2,0,0]=4 1045 B12R2.315 CSc1nccc2c1nc[nH]2 62a_200000210301_100009820035 [0,1,0,0,1,0|1,0,1]=4 1046 B12R2.315 CSc1nccc2c1scc2 62a_200000210301_100000117209 [0,1,0,0,1,0|2,0,0]=4 1047 B12R2.315 CSc1nccn2c1ccn2 62a_200000210301_100009846796 [0,1,0,0,1,0|2,0,0]=4 1048 B12R2.315 CSc1nccn2c1ncc2 62a_200000210301_102495338505 [0,1,0,0,1,0|2,0,0]=4 1049 B12R2.315 CSc1nccn2c1ncn2 62a_200000210301_100000094309 [0,1,0,0,1,0|2,0,0]=4 1050 B12R2.315 [13CH3]Nc1cccc2c1ccs2 34a_100020628958_200025704644 [0,1,0,0,1,0|1,0,0]=3 1051 B12R2.315 [13CH3]Nc1cccc2c1nco2 34a_100000717946_200025704644 [0,1,0,0,1,0|1,0,0]=3 1052 B12R2.315 [13CH3]Nc1cccc2c1scn2 34a_100000099145_200025704644 [0,1,0,0,1,0|1,0,0]=3 1053 B12R2.315 [13CH3]Oc1cccc2c1cc[nH]2 34a_100000763377_200025704644 [0,1,0,0,1,0|0,0,1]=3 1054 B12R2.315 [13CH3]Oc1cccc2c1ccs2 34a_100000077759_200025704644 [0,1,0,0,1,0|1,0,0]=3 1055 B12R2.315 [13CH3]Oc1cccc2c1ccs2 7a_100000077759_200025704644 [0,1,0,0,1,0|1,0,0]=3 1056 B12R2.315 [13CH3]Oc1cccc2c1ncs2 34a_100000101385_200025704644 [0,1,0,0,1,0|1,0,0]=3 1057 B12R2.315 [13CH3]Oc1cccc2c1ncs2 7a_100000101385_200025704644 [0,1,0,0,1,0|1,0,0]=3 1058 B12R2.315 [13CH3]Oc1cccn2c1ncc2 34a_100000068405_200025704644 [0,1,0,0,1,0|1,0,0]=3 1059 B12R2.315 [13CH3]Oc1cccn2c1ncc2 7a_100000068405_200025704644 [0,1,0,0,1,0|1,0,0]=3 1060 B12R2.315 [13CH3]Oc1ccnc2c1scc2 34a_100000759877_200025704644 [0,1,0,0,1,0|2,0,0]=4 1061 B12R2.315 [13CH3]Sc1cc[nH]c-2nncc12 62a_200025704644_100015363004 [0,1,0,0,1,0|2,0,0]=4 1062 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_100009844718_200025704644 [0,1,0,0,1,0|1,0,0]=3 1063 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_200025704644_100009844718 [0,1,0,0,1,0|1,0,0]=3 1064 B12R2.315 [13CH3]Sc1cccc2c1[nH]cc2 62a_200025704644_100009813418 [0,1,0,0,1,0|0,0,1]=3 1065 B12R2.315 [13CH3]Sc1cccc2c1[nH]nc2 62a_200025704644_100009816125 [0,1,0,0,1,0|1,0,1]=4 1066 B12R2.315 [13CH3]Sc1cccc2c1[nH]nn2 62a_200025704644_100009820029 [0,1,0,0,1,0|1,0,1]=4 1067 B12R2.315 [13CH3]Sc1cccc2c1cc[nH]2 62a_200025704644_100000685724 [0,1,0,0,1,0|0,0,1]=3 1068 B12R2.315 [13CH3]Sc1cccc2c1cco2 62a_200025704644_100000756496 [0,1,0,0,1,0|1,0,0]=3 1069 B12R2.315 [13CH3]Sc1cccc2c1ccs2 62a_200025704644_100009816950 [0,1,0,0,1,0|1,0,0]=3 1070 B12R2.315 [13CH3]Sc1cccc2c1cn[nH]2 62a_200025704644_100000753301 [0,1,0,0,1,0|1,0,1]=4 1071 B12R2.315 [13CH3]Sc1cccc2c1cno2 62a_200025704644_100009818589 [0,1,0,0,1,0|2,0,0]=4 1072 B12R2.315 [13CH3]Sc1cccc2c1nc[nH]2 62a_200025704644_100011935113 [0,1,0,0,1,0|0,0,1]=3 1073 B12R2.315 [13CH3]Sc1cccc2c1nco2 62a_200025704644_100009816834 [0,1,0,0,1,0|1,0,0]=3 1074 B12R2.315 [13CH3]Sc1cccc2c1ncs2 62a_200025704644_100000726125 [0,1,0,0,1,0|1,0,0]=3 1075 B12R2.315 [13CH3]Sc1cccc2c1non2 62a_100009820244_200025704644 [0,1,0,0,1,0|1,0,0]=3 1076 B12R2.315 [13CH3]Sc1cccc2c1non2 62a_200025704644_100009820244 [0,1,0,0,1,0|1,0,0]=3 1077 B12R2.315 [13CH3]Sc1cccc2c1nsn2 62a_200025704644_100000742359 [0,1,0,0,1,0|1,0,0]=3 1078 B12R2.315 [13CH3]Sc1cccc2c1occ2 62a_200025704644_100011935138 [0,1,0,0,1,0|1,0,0]=3 1079 B12R2.315 [13CH3]Sc1cccc2c1ocn2 62a_200025704644_100000728214 [0,1,0,0,1,0|1,0,0]=3 1080 B12R2.315 [13CH3]Sc1cccc2c1onc2 62a_200025704644_100000765530 [0,1,0,0,1,0|2,0,0]=4 1081 B12R2.315 [13CH3]Sc1cccc2c1scc2 62a_200025704644_100000766737 [0,1,0,0,1,0|1,0,0]=3 1082 B12R2.315 [13CH3]Sc1cccc2c1scn2 62a_200025704644_100010246326 [0,1,0,0,1,0|1,0,0]=3 1083 B12R2.315 [13CH3]Sc1cccc2n1ccn2 62a_100000762677_200025704644 [0,1,0,0,1,0|1,0,0]=3 1084 B12R2.315 [13CH3]Sc1cccc2n1ccn2 62a_200025704644_100000762677 [0,1,0,0,1,0|1,0,0]=3 1085 B12R2.315 [13CH3]Sc1cccc2n1cnn2 62a_100009819885_200025704644 [0,1,0,0,1,0|2,0,0]=4 1086 B12R2.315 [13CH3]Sc1cccc2n1cnn2 62a_200025704644_100009819885 [0,1,0,0,1,0|2,0,0]=4 1087 B12R2.315 [13CH3]Sc1cccc2n1ncc2 62a_200025704644_100009817731 [0,1,0,0,1,0|1,0,0]=3 1088 B12R2.315 [13CH3]Sc1cccc2n1ncn2 62a_200025704644_100009819724 [0,1,0,0,1,0|1,0,0]=3 1089 B12R2.315 [13CH3]Sc1cccn2c1ccn2 62a_200025704644_100010767162 [0,1,0,0,1,0|1,0,0]=3 1090 B12R2.315 [13CH3]Sc1cccn2c1ncc2 62a_200025704644_100011934911 [0,1,0,0,1,0|1,0,0]=3 1091 B12R2.315 [13CH3]Sc1cccn2c1ncn2 62a_200025704644_100009819722 [0,1,0,0,1,0|1,0,0]=3 1092 B12R2.315 [13CH3]Sc1cccn2c1nnc2 62a_200025704644_100000764285 [0,1,0,0,1,0|2,0,0]=4 1093 B12R2.315 [13CH3]Sc1cccn2c1nnn2 62a_200025704644_100009852330 [0,1,0,0,1,0|2,0,0]=4 1094 B12R2.315 [13CH3]Sc1ccnc2c1[nH]cc2 62a_200025704644_100000087553 [0,1,0,0,1,0|1,0,1]=4 1095 B12R2.315 [13CH3]Sc1ccnc2c1cc[nH]2 62a_200025704644_100000766882 [0,1,0,0,1,0|1,0,1]=4 1096 B12R2.315 [13CH3]Sc1ccnc2c1ccs2 62a_200025704644_100009861243 [0,1,0,0,1,0|2,0,0]=4 1097 B12R2.315 [13CH3]Sc1ccnc2c1nc[nH]2 62a_200025704644_100009820729 [0,1,0,0,1,0|1,0,1]=4 1098 B12R2.315 [13CH3]Sc1ccnc2c1occ2 62a_200025704644_100009853057 [0,1,0,0,1,0|2,0,0]=4 1099 B12R2.315 [13CH3]Sc1ccnc2c1scc2 62a_200025704644_100000764135 [0,1,0,0,1,0|2,0,0]=4 1100 B12R2.315 [13CH3]Sc1ccnc2n1ncc2 62a_200025704644_100000080991 [0,1,0,0,1,0|2,0,0]=4 1101 B12R2.315 [13CH3]Sc1cncc2c1[nH]cc2 62a_200025704644_100000217057 [0,1,0,0,1,0|1,0,1]=4 1102 B12R2.315 [13CH3]Sc1cncc2c1[nH]cn2 62a_200025704644_100000759552 [0,1,0,0,1,0|1,0,1]=4 1103 B12R2.315 [13CH3]Sc1cncc2c1cc[nH]2 62a_200025704644_100009840476 [0,1,0,0,1,0|1,0,1]=4 1104 B12R2.315 [13CH3]Sc1cncc2n1ccn2 62a_100009818520_200025704644 [0,1,0,0,1,0|2,0,0]=4 1105 B12R2.315 [13CH3]Sc1cncc2n1ccn2 62a_200025704644_100009818520 [0,1,0,0,1,0|2,0,0]=4 1106 B12R2.315 [13CH3]Sc1nc[nH]c-2nccc12 62a_200025704644_100015350423 [0,1,0,0,1,0|2,0,0]=4 1107 B12R2.315 [13CH3]Sc1nccc2c1[nH]cc2 62a_200025704644_100000060748 [0,1,0,0,1,0|1,0,1]=4 1108 B12R2.315 [13CH3]Sc1nccc2c1c[nH]n2 62a_200025704644_100020876377 [0,1,0,0,1,0|2,0,0]=4 1109 B12R2.315 [13CH3]Sc1nccc2c1cc[nH]2 62a_200025704644_100000086534 [0,1,0,0,1,0|1,0,1]=4 1110 B12R2.315 [13CH3]Sc1nccc2c1cco2 62a_200025704644_100000041166 [0,1,0,0,1,0|2,0,0]=4 1111 B12R2.315 [13CH3]Sc1nccc2c1ccs2 62a_200025704644_100000047778 [0,1,0,0,1,0|2,0,0]=4 1112 B12R2.315 [13CH3]Sc1nccc2c1nc[nH]2 62a_200025704644_100009820035 [0,1,0,0,1,0|1,0,1]=4 1113 B12R2.315 [13CH3]Sc1nccc2c1scc2 62a_200025704644_100000117209 [0,1,0,0,1,0|2,0,0]=4 1114 B12R2.315 [13CH3]Sc1nccn2c1ccn2 62a_200025704644_100009846796 [0,1,0,0,1,0|2,0,0]=4 1115 B12R2.315 [13CH3]Sc1nccn2c1ncc2 62a_200025704644_102495338505 [0,1,0,0,1,0|2,0,0]=4 1116 B12R2.315 [13CH3]Sc1nccn2c1ncn2 62a_200025704644_100000094309 [0,1,0,0,1,0|2,0,0]=4 1117 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [0,2,0,0,0,0|2,0,0]=4 1118 B14R2.92 C=Cc1ccc2cccnc2c1C 271570a_100011290941_100010214467 [0,2,0,0,0,0|1,0,0]=3 1119 B14R2.92 C=Cc1ccc2cccnc2c1F 271570a_100011290941_100010751467 [0,2,0,0,0,0|2,0,0]=4 1120 B14R2.92 C=Cc1ccc2cccnc2c1O 271570a_100011290941_100009816563 [0,2,0,0,0,0|2,0,0]=4 1121 B14R2.92 C=Cc1ccc2ncccc2c1C 271570a_100011290941_200010137439 [0,2,0,0,0,0|1,0,0]=3 1122 B14R2.92 C=Cc1ccc2ncccc2c1N 271570a_100011290941_200010235790 [0,2,0,0,0,0|2,0,0]=4 1123 B14R2.92 C=Cc1ccc2nccnc2c1C 271570a_100011290941_100135414757 [0,2,0,0,0,0|0,0,0]=2 1124 B14R2.92 CNc1ccc2ncccc2c1Br 34a_200009995563_200000210301 [0,2,0,0,0,0|2,0,0]=4 1125 B14R2.92 CNc1ccc2nccnc2c1C 27a_100102657272_100135414757 [0,2,0,0,0,0|0,0,0]=2 1126 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,2,0,0,0,0|2,0,0]=4 1127 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,2,0,0,0,0|2,0,0]=4 1128 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [0,2,0,0,0,0|2,0,0]=4 1129 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [0,2,0,0,0,0|2,0,0]=4 1130 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [0,2,0,0,0,0|2,0,0]=4 1131 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [0,2,0,0,0,0|2,0,0]=4 1132 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [0,2,0,0,0,0|2,0,0]=4 1133 B14R2.92 CSc1ccc2cccnc2c1C 62a_200000210301_100010214467 [0,2,0,0,0,0|1,0,0]=3 1134 B14R2.92 CSc1ccc2cccnc2c1F 62a_100010751467_200000210301 [0,2,0,0,0,0|2,0,0]=4 1135 B14R2.92 CSc1ccc2cccnc2c1F 62a_200000210301_100010751467 [0,2,0,0,0,0|2,0,0]=4 1136 B14R2.92 CSc1ccc2cccnc2c1O 62a_200000210301_100009816563 [0,2,0,0,0,0|2,0,0]=4 1137 B14R2.92 CSc1ccc2ncccc2c1C 62a_200000210301_200010137439 [0,2,0,0,0,0|1,0,0]=3 1138 B14R2.92 CSc1ccc2ncccc2c1C 62a_200010137439_200000210301 [0,2,0,0,0,0|1,0,0]=3 1139 B14R2.92 CSc1ccc2ncccc2c1N 62a_200010235790_200000210301 [0,2,0,0,0,0|2,0,0]=4 1140 B14R2.92 CSc1ccc2nccnc2c1C 62a_100135414757_200000210301 [0,2,0,0,0,0|0,0,0]=2 1141 B14R2.92 CSc1ccc2nccnc2c1C 62a_200000210301_100135414757 [0,2,0,0,0,0|0,0,0]=2 1142 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,2,0,0,0,0|2,0,0]=4 1143 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,2,0,0,0,0|2,0,0]=4 1144 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [0,2,0,0,0,0|2,0,0]=4 1145 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [0,2,0,0,0,0|2,0,0]=4 1146 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200010137439_200025704644 [0,2,0,0,0,0|1,0,0]=3 1147 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200025704644_200010137439 [0,2,0,0,0,0|1,0,0]=3 1148 B14R2.92 Cc1c(ccc2c1nccc2)S[13CH3] 62a_200025704644_100010214467 [0,2,0,0,0,0|1,0,0]=3 1149 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_100135414757_200025704644 [0,2,0,0,0,0|0,0,0]=2 1150 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_200025704644_100135414757 [0,2,0,0,0,0|0,0,0]=2 1151 B14R2.92 [13CH3]Nc1ccc2ncccc2c1Br 34a_200009995563_200025704644 [0,2,0,0,0,0|2,0,0]=4 1152 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [0,2,0,0,0,0|2,0,0]=4 1153 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [0,2,0,0,0,0|2,0,0]=4 1154 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_100010751467_200025704644 [0,2,0,0,0,0|2,0,0]=4 1155 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_200025704644_100010751467 [0,2,0,0,0,0|2,0,0]=4 1156 B14R2.92 [13CH3]Sc1ccc2cccnc2c1O 62a_200025704644_100009816563 [0,2,0,0,0,0|2,0,0]=4 1157 B14R2.92 [13CH3]Sc1ccc2ncccc2c1N 62a_200010235790_200025704644 [0,2,0,0,0,0|2,0,0]=4 1158 B14R2.203 C=Cc1c(ccc2c1cccn2)N 271570a_100011290941_200009995563 [0,2,0,0,0,0|1,0,1]=4 1159 B14R2.203 C=Cc1c(ccc2c1nccc2)O 271570a_100011290941_100010173343 [0,2,0,0,0,0|1,0,1]=4 1160 B14R2.203 C=Cc1c(ccc2c1nccn2)N 271570a_100011290941_100000729981 [0,2,0,0,0,0|0,0,1]=3 1161 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [0,2,0,0,0,0|2,0,0]=4 1162 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [0,2,0,0,0,0|2,0,0]=4 1163 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [0,2,0,0,0,0|2,0,0]=4 1164 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [0,2,0,0,0,0|2,0,0]=4 1165 B14R2.203 CNc1c(ccc2c1cccn2)C 34a_100011933972_200000210301 [0,2,0,0,0,0|1,0,0]=3 1166 B14R2.203 CNc1c(ccc2c1nccc2)C 34a_100000065890_200000210301 [0,2,0,0,0,0|1,0,0]=3 1167 B14R2.203 CNc1c(ccc2c1nccn2)N 27a_100102657272_100000729981 [0,2,0,0,0,0|0,0,0]=2 1168 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 1169 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 1170 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [0,2,0,0,0,0|2,0,0]=4 1171 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [0,2,0,0,0,0|2,0,0]=4 1172 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [0,2,0,0,0,0|2,0,0]=4 1173 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [0,2,0,0,0,0|2,0,0]=4 1174 B14R2.203 COc1c(ccc2c1nccc2)Br 34a_100009816563_200000210301 [0,2,0,0,0,0|1,0,0]=3 1175 B14R2.203 COc1c(ccc2c1nccc2)Cl 34a_100000700379_200000210301 [0,2,0,0,0,0|1,0,0]=3 1176 B14R2.203 COc1c(ccc2c1nccc2)Cl 7a_100000700379_200000210301 [0,2,0,0,0,0|1,0,0]=3 1177 B14R2.203 COc1c(ccc2c1nccc2)O 271570a_203496583355_100010256708 [0,2,0,0,0,0|1,0,0]=3 1178 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [0,2,0,0,0,0|2,0,0]=4 1179 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [0,2,0,0,0,0|2,0,0]=4 1180 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [0,2,0,0,0,0|2,0,0]=4 1181 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [0,2,0,0,0,0|2,0,0]=4 1182 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [0,2,0,0,0,0|2,0,0]=4 1183 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [0,2,0,0,0,0|2,0,0]=4 1184 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [0,2,0,0,0,0|2,0,0]=4 1185 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200000210301_200009995563 [0,2,0,0,0,0|1,0,0]=3 1186 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200009995563_200000210301 [0,2,0,0,0,0|1,0,0]=3 1187 B14R2.203 CSc1c(ccc2c1nccc2)O 62a_200000210301_100010173343 [0,2,0,0,0,0|1,0,0]=3 1188 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_100000729981_200000210301 [0,2,0,0,0,0|0,0,0]=2 1189 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_200000210301_100000729981 [0,2,0,0,0,0|0,0,0]=2 1190 B14R2.203 CSc1c(cnc2c1nccc2)N 62a_200000210301_100009889961 [0,2,0,0,0,0|2,0,0]=4 1191 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [0,2,0,0,0,0|2,0,0]=4 1192 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [0,2,0,0,0,0|2,0,0]=4 1193 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [0,2,0,0,0,0|2,0,0]=4 1194 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [0,2,0,0,0,0|2,0,0]=4 1195 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [0,2,0,0,0,0|2,0,0]=4 1196 B14R2.203 Cc1ccc2cccnc2c1N[13CH3] 34a_100000065890_200025704644 [0,2,0,0,0,0|1,0,0]=3 1197 B14R2.203 Cc1ccc2ncccc2c1N[13CH3] 34a_100011933972_200025704644 [0,2,0,0,0,0|1,0,0]=3 1198 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [0,2,0,0,0,0|2,0,0]=4 1199 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [0,2,0,0,0,0|2,0,0]=4 1200 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [0,2,0,0,0,0|2,0,0]=4 1201 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 1202 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 1203 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [0,2,0,0,0,0|2,0,0]=4 1204 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Br 34a_100009816563_200025704644 [0,2,0,0,0,0|1,0,0]=3 1205 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 34a_100000700379_200025704644 [0,2,0,0,0,0|1,0,0]=3 1206 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 7a_100000700379_200025704644 [0,2,0,0,0,0|1,0,0]=3 1207 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [0,2,0,0,0,0|2,0,0]=4 1208 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [0,2,0,0,0,0|2,0,0]=4 1209 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [0,2,0,0,0,0|2,0,0]=4 1210 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [0,2,0,0,0,0|2,0,0]=4 1211 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [0,2,0,0,0,0|2,0,0]=4 1212 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200009995563_200025704644 [0,2,0,0,0,0|1,0,0]=3 1213 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200025704644_200009995563 [0,2,0,0,0,0|1,0,0]=3 1214 B14R2.203 [13CH3]Sc1c(ccc2c1nccc2)O 62a_200025704644_100010173343 [0,2,0,0,0,0|1,0,0]=3 1215 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_100000729981_200025704644 [0,2,0,0,0,0|0,0,0]=2 1216 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_200025704644_100000729981 [0,2,0,0,0,0|0,0,0]=2 1217 B14R2.203 [13CH3]Sc1c(cnc2c1nccc2)N 62a_200025704644_100009889961 [0,2,0,0,0,0|2,0,0]=4 1218 B14R2.7724 Oc1cc(c2cccnc2c1O)Cl 271570a_203496583355_100000211503 [0,2,0,0,0,0|2,0,0]=4 1219 B14R2.7724 Oc1cc(c2ncccc2c1F)F 271570a_203496583355_200009817093 [0,2,0,0,0,0|2,0,0]=4 1220 B14R2.8038 Cc1c(ccc2c1nccc2O)F 271570a_203496583355_100011516163 [0,2,0,0,0,0|1,0,0]=3 1221 B14R2.8038 Cc1ccc2c(ccnc2c1C)O 271570a_203496583355_100011310510 [0,2,0,0,0,0|1,0,0]=3 1222 B14R2.8188 Oc1c(cc2ncccc2c1F)F 271570a_203496583355_100010163946 [0,2,0,0,0,0|2,0,0]=4 1223 B14R2.28523 Cc1c(ccc2c1c(=O)[nH]cn2)O 271570a_203496583355_206256548267 [0,2,0,0,0,0|2,0,0]=4 1224 B14R2.29369 Cc1ccc2c(c(ccc2n1)F)O 271570a_203496583355_100010730238 [0,2,0,0,0,0|2,0,0]=4 1225 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [0,2,0,0,0,0|2,0,0]=4 1226 B14R2.142 C=Cc1ccc2cccc(c2c1)C 271570a_100011290941_100010089936 [0,2,0,0,0,0|2,0,0]=4 1227 B14R2.142 C=Cc1ccc2cccc(c2n1)C 271570a_100011290941_100012002297 [0,2,0,0,0,0|1,0,0]=3 1228 B14R2.142 C=Cc1ccc2cccc(c2n1)F 271570a_100011290941_100012017632 [0,2,0,0,0,0|2,0,0]=4 1229 B14R2.142 C=Cc1ccc2cccc(c2n1)O 271570a_100011290941_100010153751 [0,2,0,0,0,0|2,0,0]=4 1230 B14R2.142 C=Cc1cnc2cccc(c2c1)N 271570a_100011290941_100010264086 [0,2,0,0,0,0|2,0,0]=4 1231 B14R2.142 C=Cc1cnc2cccc(c2c1)O 271570a_100011290941_200010153752 [0,2,0,0,0,0|2,0,0]=4 1232 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [0,2,0,0,0,0|1,0,0]=3 1233 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [0,2,0,0,0,0|2,0,0]=4 1234 B14R2.142 COc1ccc2cccc(c2c1)C 34a_200000091600_200000210301 [0,2,0,0,0,0|2,0,0]=4 1235 B14R2.142 COc1ccc2cccc(c2c1)C 7a_200000091600_200000210301 [0,2,0,0,0,0|2,0,0]=4 1236 B14R2.142 CSc1ccc2cccc(c2c1)C 62a_200000210301_100010089936 [0,2,0,0,0,0|2,0,0]=4 1237 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [0,2,0,0,0,0|1,0,0]=3 1238 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [0,2,0,0,0,0|2,0,0]=4 1239 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [0,2,0,0,0,0|2,0,0]=4 1240 B14R2.142 CSc1cnc2cccc(c2c1)N 62a_100010264086_200000210301 [0,2,0,0,0,0|2,0,0]=4 1241 B14R2.142 CSc1cnc2cccc(c2c1)N 62a_200000210301_100010264086 [0,2,0,0,0,0|2,0,0]=4 1242 B14R2.142 CSc1cnc2cccc(c2c1)O 62a_200000210301_200010153752 [0,2,0,0,0,0|2,0,0]=4 1243 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 34a_200000091600_200025704644 [0,2,0,0,0,0|2,0,0]=4 1244 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 7a_200000091600_200025704644 [0,2,0,0,0,0|2,0,0]=4 1245 B14R2.142 Cc1cccc2c1cc(cc2)S[13CH3] 62a_200025704644_100010089936 [0,2,0,0,0,0|2,0,0]=4 1246 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [0,2,0,0,0,0|1,0,0]=3 1247 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [0,2,0,0,0,0|2,0,0]=4 1248 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [0,2,0,0,0,0|2,0,0]=4 1249 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)N 62a_100010264086_200025704644 [0,2,0,0,0,0|2,0,0]=4 1250 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)N 62a_200025704644_100010264086 [0,2,0,0,0,0|2,0,0]=4 1251 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)O 62a_200025704644_200010153752 [0,2,0,0,0,0|2,0,0]=4 1252 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [0,2,0,0,0,0|1,0,0]=3 1253 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [0,2,0,0,0,0|2,0,0]=4 1254 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [0,2,0,0,0,0|2,0,0]=4 1255 B14R2.8045 Cc1cc(c2nccc(c2c1)O)C 271570a_203496583355_100011310474 [0,2,0,0,0,0|1,0,0]=3 1256 B14R2.8045 Cc1cc(nc2c1cccc2C)O 271570a_203496583355_100000008058 [0,2,0,0,0,0|1,0,0]=3 1257 B14R2.8045 Oc1ccnc2c1cc(cc2F)F 271570a_203496583355_100000751274 [0,2,0,0,0,0|2,0,0]=4 1258 B14R2.8235 Cc1cc(c2nc(ccc2c1)O)C 271570a_203496583355_200012017542 [0,2,0,0,0,0|1,0,0]=3 1259 B14R2.8751 Cc1ccc2c(ccc(c2n1)N)O 271570a_203496583355_100012970290 [0,2,0,0,0,0|2,0,0]=4 1260 B14R2.11684 C=Cc1cccc2c1nc(cc2)C 271570a_100011290941_100011934484 [0,2,0,0,0,0|1,0,1]=4 1261 B14R2.11684 C=Cc1cccc2c1nc(cc2)N 271570a_100011290941_100000687151 [0,2,0,0,0,0|1,0,1]=4 1262 B14R2.11684 CNc1cccc2c1cc(cc2)Br 34a_100010090012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1263 B14R2.11684 CNc1cccc2c1cc(cc2)O 34a_100000034012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1264 B14R2.11684 CNc1cccc2c1cc(cn2)Br 34a_100010264086_200000210301 [0,2,0,0,0,0|1,0,0]=3 1265 B14R2.11684 CNc1cccc2c1cc(nn2)C 34a_100000033955_200000210301 [0,2,0,0,0,0|2,0,0]=4 1266 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [0,2,0,0,0,0|1,0,0]=3 1267 B14R2.11684 CNc1ccnc2c1nc(cc2)C 27a_100102657272_100009889967 [0,2,0,0,0,0|2,0,0]=4 1268 B14R2.11684 CNc1ccnc2c1nc(cc2)F 27a_100102657272_100000719316 [0,2,0,0,0,0|2,0,0]=4 1269 B14R2.11684 COc1cccc2c1cc(cc2)Br 34a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 1270 B14R2.11684 COc1cccc2c1cc(cc2)Br 7a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 1271 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [0,2,0,0,0,0|2,0,0]=4 1272 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [0,2,0,0,0,0|2,0,0]=4 1273 B14R2.11684 COc1cccc2c1cc(cc2)Cl 34a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 1274 B14R2.11684 COc1cccc2c1cc(cc2)Cl 7a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 1275 B14R2.11684 COc1cccc2c1cc(cc2)F 34a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 1276 B14R2.11684 COc1cccc2c1cc(cc2)F 7a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 1277 B14R2.11684 COc1cccc2c1cc(cc2)N 34a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1278 B14R2.11684 COc1cccc2c1cc(cc2)N 7a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1279 B14R2.11684 COc1cccc2c1cc(cn2)Br 34a_200010153752_200000210301 [0,2,0,0,0,0|1,0,0]=3 1280 B14R2.11684 COc1cccc2c1cc(cn2)Br 7a_200010153752_200000210301 [0,2,0,0,0,0|1,0,0]=3 1281 B14R2.11684 COc1cccc2c1cc(cn2)N 34a_100009853962_200000210301 [0,2,0,0,0,0|1,0,0]=3 1282 B14R2.11684 COc1cccc2c1nc(cc2)Br 34a_100010153751_200000210301 [0,2,0,0,0,0|1,0,0]=3 1283 B14R2.11684 COc1cccc2c1nc(cc2)Br 7a_100010153751_200000210301 [0,2,0,0,0,0|1,0,0]=3 1284 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [0,2,0,0,0,0|1,0,0]=3 1285 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [0,2,0,0,0,0|1,0,0]=3 1286 B14R2.11684 COc1cccc2c1nc(cc2)Cl 34a_100000013812_200000210301 [0,2,0,0,0,0|1,0,0]=3 1287 B14R2.11684 COc1cccc2c1nc(cc2)Cl 7a_100000013812_200000210301 [0,2,0,0,0,0|1,0,0]=3 1288 B14R2.11684 COc1cccc2c1nc(cc2)N 34a_100000032106_200000210301 [0,2,0,0,0,0|1,0,0]=3 1289 B14R2.11684 COc1cccc2c1nc(cc2)N 7a_100000032106_200000210301 [0,2,0,0,0,0|1,0,0]=3 1290 B14R2.11684 COc1cccc2c1nc(cc2)O 271570a_203496583355_200011787714 [0,2,0,0,0,0|1,0,0]=3 1291 B14R2.11684 COc1cccc2c1nc(cn2)O 271570a_203496583355_100010783442 [0,2,0,0,0,0|0,0,0]=2 1292 B14R2.11684 COc1cccc2c1nc(nc2)Cl 34a_100010674811_200000210301 [0,2,0,0,0,0|2,0,0]=4 1293 B14R2.11684 COc1cccc2c1nc(nc2)Cl 7a_100010674811_200000210301 [0,2,0,0,0,0|2,0,0]=4 1294 B14R2.11684 COc1cccc2c1nc(nc2)O 271570a_203496583355_200000095598 [0,2,0,0,0,0|2,0,0]=4 1295 B14R2.11684 CSc1cccc2c1[nH]c(=O)cc2 62a_200000210301_100000688906 [0,2,0,0,0,0|1,0,1]=4 1296 B14R2.11684 CSc1cccc2c1cc(cc2)O 62a_200000210301_100010169565 [0,2,0,0,0,0|2,0,0]=4 1297 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [0,2,0,0,0,0|1,0,0]=3 1298 B14R2.11684 CSc1cccc2c1nc(cc2)Cl 62a_200000210301_100012034269 [0,2,0,0,0,0|1,0,0]=3 1299 B14R2.11684 CSc1cccc2c1nc(cc2)N 62a_100000687151_200000210301 [0,2,0,0,0,0|1,0,0]=3 1300 B14R2.11684 CSc1cccc2c1nc(nc2)N 62a_200000210301_200010988910 [0,2,0,0,0,0|2,0,0]=4 1301 B14R2.11684 CSc1cccc2c1nc(nc2)N 62a_200010988910_200000210301 [0,2,0,0,0,0|2,0,0]=4 1302 B14R2.11684 CSc1ccnc2c1nc(cc2)C 62a_200000210301_100009889967 [0,2,0,0,0,0|2,0,0]=4 1303 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_100000719316_200000210301 [0,2,0,0,0,0|2,0,0]=4 1304 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_200000210301_100000719316 [0,2,0,0,0,0|2,0,0]=4 1305 B14R2.11684 CSc1cncc2c1nc(cc2)O 62a_200000210301_100009812673 [0,2,0,0,0,0|2,0,0]=4 1306 B14R2.11684 Cc1cc2c(cccc2nn1)N[13CH3] 34a_100000033955_200025704644 [0,2,0,0,0,0|2,0,0]=4 1307 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [0,2,0,0,0,0|2,0,0]=4 1308 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [0,2,0,0,0,0|2,0,0]=4 1309 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [0,2,0,0,0,0|1,0,0]=3 1310 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [0,2,0,0,0,0|1,0,0]=3 1311 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [0,2,0,0,0,0|1,0,0]=3 1312 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [0,2,0,0,0,0|1,0,0]=3 1313 B14R2.11684 Cc1ccc2nccc(c2n1)S[13CH3] 62a_200025704644_100009889967 [0,2,0,0,0,0|2,0,0]=4 1314 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)Br 34a_100010090012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1315 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)O 34a_100000034012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1316 B14R2.11684 [13CH3]Nc1cccc2c1cc(cn2)Br 34a_100010264086_200025704644 [0,2,0,0,0,0|1,0,0]=3 1317 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 34a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 1318 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 7a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 1319 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 34a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 1320 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 7a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 1321 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 34a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 1322 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 7a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 1323 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 34a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 1324 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 7a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 1325 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)Br 34a_200010153752_200025704644 [0,2,0,0,0,0|1,0,0]=3 1326 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)Br 7a_200010153752_200025704644 [0,2,0,0,0,0|1,0,0]=3 1327 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)N 34a_100009853962_200025704644 [0,2,0,0,0,0|1,0,0]=3 1328 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 34a_100010153751_200025704644 [0,2,0,0,0,0|1,0,0]=3 1329 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 7a_100010153751_200025704644 [0,2,0,0,0,0|1,0,0]=3 1330 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 34a_100000013812_200025704644 [0,2,0,0,0,0|1,0,0]=3 1331 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 7a_100000013812_200025704644 [0,2,0,0,0,0|1,0,0]=3 1332 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 34a_100000032106_200025704644 [0,2,0,0,0,0|1,0,0]=3 1333 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 7a_100000032106_200025704644 [0,2,0,0,0,0|1,0,0]=3 1334 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 34a_100010674811_200025704644 [0,2,0,0,0,0|2,0,0]=4 1335 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 7a_100010674811_200025704644 [0,2,0,0,0,0|2,0,0]=4 1336 B14R2.11684 [13CH3]Sc1cccc2c1[nH]c(=O)cc2 62a_200025704644_100000688906 [0,2,0,0,0,0|1,0,1]=4 1337 B14R2.11684 [13CH3]Sc1cccc2c1cc(cc2)O 62a_200025704644_100010169565 [0,2,0,0,0,0|2,0,0]=4 1338 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)Cl 62a_200025704644_100012034269 [0,2,0,0,0,0|1,0,0]=3 1339 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)N 62a_100000687151_200025704644 [0,2,0,0,0,0|1,0,0]=3 1340 B14R2.11684 [13CH3]Sc1cccc2c1nc(nc2)N 62a_200010988910_200025704644 [0,2,0,0,0,0|2,0,0]=4 1341 B14R2.11684 [13CH3]Sc1cccc2c1nc(nc2)N 62a_200025704644_200010988910 [0,2,0,0,0,0|2,0,0]=4 1342 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_100000719316_200025704644 [0,2,0,0,0,0|2,0,0]=4 1343 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_200025704644_100000719316 [0,2,0,0,0,0|2,0,0]=4 1344 B14R2.11684 [13CH3]Sc1cncc2c1nc(cc2)O 62a_200025704644_100009812673 [0,2,0,0,0,0|2,0,0]=4 1345 B14R2.28472 Cc1nc2ccnc(c2nc1C)O 271570a_203496583355_200000029173 [0,2,0,0,0,0|2,0,0]=4 1346 B14R2.28472 Oc1nc2c(cccc2cc1F)O 271570a_203496583355_100010140959 [0,2,0,0,0,0|2,0,0]=4 1347 B14R2.1019 C=Cc1cc(c2cccnc2c1)N 271570a_100011290941_200010263263 [0,2,0,0,0,0|2,0,0]=4 1348 B14R2.1019 C=Cc1cc(c2ncccc2c1)C 271570a_100011290941_100010130319 [0,2,0,0,0,0|1,0,0]=3 1349 B14R2.1019 C=Cc1cc(c2ncccc2c1)Cl 271570a_100011290941_200010369337 [0,2,0,0,0,0|2,0,0]=4 1350 B14R2.1019 C=Cc1cc(c2ncccc2c1)F 271570a_100011290941_100010234705 [0,2,0,0,0,0|2,0,0]=4 1351 B14R2.1019 C=Cc1cc(c2ncccc2c1)N 271570a_100011290941_100009814519 [0,2,0,0,0,0|2,0,0]=4 1352 B14R2.1019 C=Cc1cc(c2ncccc2c1)O 271570a_100011290941_100010248853 [0,2,0,0,0,0|2,0,0]=4 1353 B14R2.1019 C=Cc1cc(c2nccnc2c1)C 271570a_100011290941_100010080486 [0,2,0,0,0,0|0,0,0]=2 1354 B14R2.1019 C=Cc1cc(c2nccnc2c1)F 271570a_100011290941_100010079260 [0,2,0,0,0,0|1,0,0]=3 1355 B14R2.1019 CNc1cc(c2ncccc2c1)Cl 34a_200009830422_200000210301 [0,2,0,0,0,0|2,0,0]=4 1356 B14R2.1019 CNc1cc(c2nccnc2c1)C 27a_100102657272_100010080486 [0,2,0,0,0,0|0,0,0]=2 1357 B14R2.1019 CNc1cc(c2nccnc2c1)F 27a_100102657272_100010079260 [0,2,0,0,0,0|1,0,0]=3 1358 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [0,2,0,0,0,0|2,0,0]=4 1359 B14R2.1019 COc1cc(c2ncccc2c1)Cl 34a_100000097192_200000210301 [0,2,0,0,0,0|2,0,0]=4 1360 B14R2.1019 COc1cc(c2ncccc2c1)Cl 7a_100000097192_200000210301 [0,2,0,0,0,0|2,0,0]=4 1361 B14R2.1019 COc1cc(c2ncccc2c1)F 34a_100009888031_200000210301 [0,2,0,0,0,0|2,0,0]=4 1362 B14R2.1019 COc1cc(c2ncccc2c1)F 7a_100009888031_200000210301 [0,2,0,0,0,0|2,0,0]=4 1363 B14R2.1019 COc1cc(c2ncccc2c1)N 34a_100000083691_200000210301 [0,2,0,0,0,0|2,0,0]=4 1364 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [0,2,0,0,0,0|2,0,0]=4 1365 B14R2.1019 CSc1cc(c2cccnc2c1)N 62a_200000210301_200010263263 [0,2,0,0,0,0|2,0,0]=4 1366 B14R2.1019 CSc1cc(c2cccnc2c1)N 62a_200010263263_200000210301 [0,2,0,0,0,0|2,0,0]=4 1367 B14R2.1019 CSc1cc(c2ncccc2c1)C 62a_200000210301_100010130319 [0,2,0,0,0,0|1,0,0]=3 1368 B14R2.1019 CSc1cc(c2ncccc2c1)Cl 62a_200000210301_200010369337 [0,2,0,0,0,0|2,0,0]=4 1369 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_100010234705_200000210301 [0,2,0,0,0,0|2,0,0]=4 1370 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_200000210301_100010234705 [0,2,0,0,0,0|2,0,0]=4 1371 B14R2.1019 CSc1cc(c2ncccc2c1)N 62a_200000210301_100009814519 [0,2,0,0,0,0|2,0,0]=4 1372 B14R2.1019 CSc1cc(c2ncccc2c1)O 62a_200000210301_100010248853 [0,2,0,0,0,0|2,0,0]=4 1373 B14R2.1019 CSc1cc(c2nccnc2c1)C 62a_200000210301_100010080486 [0,2,0,0,0,0|0,0,0]=2 1374 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_100010079260_200000210301 [0,2,0,0,0,0|1,0,0]=3 1375 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_200000210301_100010079260 [0,2,0,0,0,0|1,0,0]=3 1376 B14R2.1019 Cc1cc(cc2c1nccc2)S[13CH3] 62a_200025704644_100010130319 [0,2,0,0,0,0|1,0,0]=3 1377 B14R2.1019 Cc1cc(cc2c1nccn2)S[13CH3] 62a_200025704644_100010080486 [0,2,0,0,0,0|0,0,0]=2 1378 B14R2.1019 [13CH3]Nc1cc(c2ncccc2c1)Cl 34a_200009830422_200025704644 [0,2,0,0,0,0|2,0,0]=4 1379 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 34a_100000097192_200025704644 [0,2,0,0,0,0|2,0,0]=4 1380 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 7a_100000097192_200025704644 [0,2,0,0,0,0|2,0,0]=4 1381 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 34a_100009888031_200025704644 [0,2,0,0,0,0|2,0,0]=4 1382 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 7a_100009888031_200025704644 [0,2,0,0,0,0|2,0,0]=4 1383 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)N 34a_100000083691_200025704644 [0,2,0,0,0,0|2,0,0]=4 1384 B14R2.1019 [13CH3]Sc1cc(c2cccnc2c1)N 62a_200010263263_200025704644 [0,2,0,0,0,0|2,0,0]=4 1385 B14R2.1019 [13CH3]Sc1cc(c2cccnc2c1)N 62a_200025704644_200010263263 [0,2,0,0,0,0|2,0,0]=4 1386 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)Cl 62a_200025704644_200010369337 [0,2,0,0,0,0|2,0,0]=4 1387 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_100010234705_200025704644 [0,2,0,0,0,0|2,0,0]=4 1388 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_200025704644_100010234705 [0,2,0,0,0,0|2,0,0]=4 1389 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)N 62a_200025704644_100009814519 [0,2,0,0,0,0|2,0,0]=4 1390 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)O 62a_200025704644_100010248853 [0,2,0,0,0,0|2,0,0]=4 1391 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_100010079260_200025704644 [0,2,0,0,0,0|1,0,0]=3 1392 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_200025704644_100010079260 [0,2,0,0,0,0|1,0,0]=3 1393 B14R2.1146 C=Cc1cc(cc2c1nccc2)Br 271570a_100011290941_100010090713 [0,2,0,0,0,0|1,0,1]=4 1394 B14R2.1146 C=Cc1cc(cc2c1nccc2)C 271570a_100011290941_100010113427 [0,2,0,0,0,0|1,0,1]=4 1395 B14R2.1146 C=Cc1cc(cc2c1nccc2)F 271570a_100011290941_100010214460 [0,2,0,0,0,0|1,0,1]=4 1396 B14R2.1146 C=Cc1cc(cc2c1nccn2)F 271570a_100011290941_100011083936 [0,2,0,0,0,0|0,0,1]=3 1397 B14R2.1146 CNc1cc(=O)[nH]c2c1cccn2 27a_100102657272_100010499609 [0,2,0,0,0,0|2,0,0]=4 1398 B14R2.1146 CNc1cc(cc2c1cccc2)Br 34a_100010171453_200000210301 [0,2,0,0,0,0|2,0,0]=4 1399 B14R2.1146 CNc1cc(cc2c1nccc2)Br 27a_100102657272_100010090713 [0,2,0,0,0,0|1,0,0]=3 1400 B14R2.1146 CNc1cc(cc2c1nccc2)Br 34a_100009814519_200000210301 [0,2,0,0,0,0|1,0,0]=3 1401 B14R2.1146 CNc1cc(cc2c1nccc2)Cl 34a_100000026717_200000210301 [0,2,0,0,0,0|1,0,0]=3 1402 B14R2.1146 CNc1cc(cc2c1nccc2)F 27a_100102657272_100010214460 [0,2,0,0,0,0|1,0,0]=3 1403 B14R2.1146 CNc1cc(cc2c1nccc2)F 34a_100000088212_200000210301 [0,2,0,0,0,0|1,0,0]=3 1404 B14R2.1146 CNc1cc(cc2c1nccc2)O 34a_100000083691_200000210301 [0,2,0,0,0,0|1,0,0]=3 1405 B14R2.1146 CNc1cc(cc2c1nccn2)F 27a_100102657272_100011083936 [0,2,0,0,0,0|0,0,0]=2 1406 B14R2.1146 CNc1cc(nc2c1cccn2)C 27a_100102657272_100009885123 [0,2,0,0,0,0|2,0,0]=4 1407 B14R2.1146 CNc1nc(cc2c1nccc2)N 27a_100102657272_100010205410 [0,2,0,0,0,0|2,0,0]=4 1408 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 1409 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 1410 B14R2.1146 COc1cc(cc2c1cccn2)O 271570a_203496583355_100010248854 [0,2,0,0,0,0|1,0,0]=3 1411 B14R2.1146 COc1cc(cc2c1nccc2)Br 34a_100010248853_200000210301 [0,2,0,0,0,0|1,0,0]=3 1412 B14R2.1146 COc1cc(cc2c1nccc2)Br 7a_100010248853_200000210301 [0,2,0,0,0,0|1,0,0]=3 1413 B14R2.1146 COc1cc(cc2c1nccc2)C 34a_100009888445_200000210301 [0,2,0,0,0,0|1,0,0]=3 1414 B14R2.1146 COc1cc(cc2c1nccc2)C 7a_100009888445_200000210301 [0,2,0,0,0,0|1,0,0]=3 1415 B14R2.1146 COc1cc(cc2c1nccc2)Cl 34a_200000089624_200000210301 [0,2,0,0,0,0|1,0,0]=3 1416 B14R2.1146 COc1cc(cc2c1nccc2)Cl 7a_200000089624_200000210301 [0,2,0,0,0,0|1,0,0]=3 1417 B14R2.1146 COc1cc(cc2c1nccc2)O 271570a_203496583355_100010248852 [0,2,0,0,0,0|1,0,0]=3 1418 B14R2.1146 CSc1cc(=O)[nH]c2c1cccn2 62a_200000210301_100010499609 [0,2,0,0,0,0|2,0,0]=4 1419 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 1420 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_200000210301_100010089974 [0,2,0,0,0,0|2,0,0]=4 1421 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [0,2,0,0,0,0|2,0,0]=4 1422 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_100010090713_200000210301 [0,2,0,0,0,0|1,0,0]=3 1423 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_200000210301_100010090713 [0,2,0,0,0,0|1,0,0]=3 1424 B14R2.1146 CSc1cc(cc2c1nccc2)C 62a_200000210301_100010113427 [0,2,0,0,0,0|1,0,0]=3 1425 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_100010214460_200000210301 [0,2,0,0,0,0|1,0,0]=3 1426 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_200000210301_100010214460 [0,2,0,0,0,0|1,0,0]=3 1427 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_100011083936_200000210301 [0,2,0,0,0,0|0,0,0]=2 1428 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_200000210301_100011083936 [0,2,0,0,0,0|0,0,0]=2 1429 B14R2.1146 CSc1cc(nc2c1cccn2)C 62a_100009885123_200000210301 [0,2,0,0,0,0|2,0,0]=4 1430 B14R2.1146 CSc1cc(nc2c1cccn2)C 62a_200000210301_100009885123 [0,2,0,0,0,0|2,0,0]=4 1431 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_100010205410_200000210301 [0,2,0,0,0,0|2,0,0]=4 1432 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_200000210301_100010205410 [0,2,0,0,0,0|2,0,0]=4 1433 B14R2.1146 Cc1cc(c2cccnc2n1)S[13CH3] 62a_100009885123_200025704644 [0,2,0,0,0,0|2,0,0]=4 1434 B14R2.1146 Cc1cc(c2cccnc2n1)S[13CH3] 62a_200025704644_100009885123 [0,2,0,0,0,0|2,0,0]=4 1435 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 34a_100009888445_200025704644 [0,2,0,0,0,0|1,0,0]=3 1436 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 7a_100009888445_200025704644 [0,2,0,0,0,0|1,0,0]=3 1437 B14R2.1146 Cc1cc(c2ncccc2c1)S[13CH3] 62a_200025704644_100010113427 [0,2,0,0,0,0|1,0,0]=3 1438 B14R2.1146 [13CH3]Nc1cc(cc2c1cccc2)Br 34a_100010171453_200025704644 [0,2,0,0,0,0|2,0,0]=4 1439 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Br 34a_100009814519_200025704644 [0,2,0,0,0,0|1,0,0]=3 1440 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200025704644 [0,2,0,0,0,0|1,0,0]=3 1441 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)F 34a_100000088212_200025704644 [0,2,0,0,0,0|1,0,0]=3 1442 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)O 34a_100000083691_200025704644 [0,2,0,0,0,0|1,0,0]=3 1443 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 1444 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 1445 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 34a_100010248853_200025704644 [0,2,0,0,0,0|1,0,0]=3 1446 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 7a_100010248853_200025704644 [0,2,0,0,0,0|1,0,0]=3 1447 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 34a_200000089624_200025704644 [0,2,0,0,0,0|1,0,0]=3 1448 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 7a_200000089624_200025704644 [0,2,0,0,0,0|1,0,0]=3 1449 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccn2 62a_200025704644_100010499609 [0,2,0,0,0,0|2,0,0]=4 1450 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 1451 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_200025704644_100010089974 [0,2,0,0,0,0|2,0,0]=4 1452 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [0,2,0,0,0,0|2,0,0]=4 1453 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_100010090713_200025704644 [0,2,0,0,0,0|1,0,0]=3 1454 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_200025704644_100010090713 [0,2,0,0,0,0|1,0,0]=3 1455 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_100010214460_200025704644 [0,2,0,0,0,0|1,0,0]=3 1456 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_200025704644_100010214460 [0,2,0,0,0,0|1,0,0]=3 1457 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_100011083936_200025704644 [0,2,0,0,0,0|0,0,0]=2 1458 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_200025704644_100011083936 [0,2,0,0,0,0|0,0,0]=2 1459 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_100010205410_200025704644 [0,2,0,0,0,0|2,0,0]=4 1460 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_200025704644_100010205410 [0,2,0,0,0,0|2,0,0]=4 1461 B14R2.28480 Cc1nc(c2c(cccc2n1)C)O 271570a_203496583355_200012002097 [0,2,0,0,0,0|2,0,0]=4 1462 B14R2.28480 Oc1ccnc2c1c(cc(c2)F)F 271570a_203496583355_100011310466 [0,2,0,0,0,0|2,0,0]=4 1463 B14R2.29365 Cc1cc(c2ccc(nc2n1)O)C 271570a_203496583355_200000075399 [0,2,0,0,0,0|2,0,0]=4 1464 B14R2.29365 Nc1cc(c2ncc(cc2c1)O)F 271570a_203496583355_100010780968 [0,2,0,0,0,0|2,0,0]=4 1465 B14R2.1078 C=Cc1cccc2c1nccc2C 271570a_100011290941_100010254272 [0,2,0,0,0,0|1,0,1]=4 1466 B14R2.1078 C=Cc1cccc2c1nccc2N 271570a_100011290941_100011620713 [0,2,0,0,0,0|1,0,1]=4 1467 B14R2.1078 C=Cc1ccnc2c1cccc2C 271570a_100011290941_100000751276 [0,2,0,0,0,0|1,0,0]=3 1468 B14R2.1078 C=Cc1ccnc2c1cccc2F 271570a_100011290941_100011934723 [0,2,0,0,0,0|2,0,0]=4 1469 B14R2.1078 C=Cc1ccnc2c1cccc2N 271570a_100011290941_100009892510 [0,2,0,0,0,0|2,0,0]=4 1470 B14R2.1078 C=Cc1ccnc2c1cccc2O 271570a_100011290941_100000703299 [0,2,0,0,0,0|2,0,0]=4 1471 B14R2.1078 C=Cc1ccnc2c1nccc2C 271570a_100011290941_200013369187 [0,2,0,0,0,0|2,0,0]=4 1472 B14R2.1078 C=Cc1ncnc2c1cccc2C 271570a_100011290941_100000751292 [0,2,0,0,0,0|2,0,0]=4 1473 B14R2.1078 CNc1cccc2c1ccc[n+]2C 34a_200021579679_200000210301 [0,2,0,0,0,0|1,0,1]=4 1474 B14R2.1078 CNc1cccc2c1cccc2Br 34a_100009816864_200000210301 [0,2,0,0,0,0|2,0,0]=4 1475 B14R2.1078 CNc1cccc2c1cccc2Cl 34a_100000077128_200000210301 [0,2,0,0,0,0|2,0,0]=4 1476 B14R2.1078 CNc1cccc2c1cccc2O 34a_100000210686_200000210301 [0,2,0,0,0,0|2,0,0]=4 1477 B14R2.1078 CNc1cccc2c1nc[nH]c2=O 27a_100102657272_100000741247 [0,2,0,0,0,0|2,0,0]=4 1478 B14R2.1078 CNc1cccc2c1nccc2C 27a_100102657272_100010254272 [0,2,0,0,0,0|1,0,0]=3 1479 B14R2.1078 CNc1cccc2c1nccc2C 34a_100011934384_200000210301 [0,2,0,0,0,0|1,0,0]=3 1480 B14R2.1078 CNc1cccc2c1nccc2Cl 34a_100009892510_200000210301 [0,2,0,0,0,0|1,0,0]=3 1481 B14R2.1078 CNc1cccc2c1ncnc2Cl 27a_100102657272_100010219103 [0,2,0,0,0,0|2,0,0]=4 1482 B14R2.1078 CNc1cccc2c1ncnc2N 27a_100102657272_100010199759 [0,2,0,0,0,0|2,0,0]=4 1483 B14R2.1078 CNc1ccnc2c1cccc2C 27a_100102657272_100000751276 [0,2,0,0,0,0|1,0,0]=3 1484 B14R2.1078 CNc1ccnc2c1cccc2F 27a_100102657272_100000751275 [0,2,0,0,0,0|2,0,0]=4 1485 B14R2.1078 CNc1ccnc2c1cccc2N 27a_100102657272_100009892510 [0,2,0,0,0,0|2,0,0]=4 1486 B14R2.1078 CNc1ccnc2c1cccc2O 27a_100102657272_100000703299 [0,2,0,0,0,0|2,0,0]=4 1487 B14R2.1078 CNc1ccnc2c1nccc2C 27a_100102657272_200013369187 [0,2,0,0,0,0|2,0,0]=4 1488 B14R2.1078 CNc1ncnc2c1cccc2C 27a_100102657272_100000751292 [0,2,0,0,0,0|2,0,0]=4 1489 B14R2.1078 COc1cccc2c1cccc2Br 34a_100010003857_200000210301 [0,2,0,0,0,0|2,0,0]=4 1490 B14R2.1078 COc1cccc2c1cccc2Br 7a_100010003857_200000210301 [0,2,0,0,0,0|2,0,0]=4 1491 B14R2.1078 COc1cccc2c1cccc2N 34a_100000210686_200000210301 [0,2,0,0,0,0|2,0,0]=4 1492 B14R2.1078 COc1cccc2c1nccc2Br 34a_100000703299_200000210301 [0,2,0,0,0,0|1,0,0]=3 1493 B14R2.1078 COc1cccc2c1nccc2Br 7a_100000703299_200000210301 [0,2,0,0,0,0|1,0,0]=3 1494 B14R2.1078 COc1cccc2c1nccc2C 7a_100000702989_200000210301 [0,2,0,0,0,0|1,0,0]=3 1495 B14R2.1078 COc1cccc2c1nccc2O 271570a_203496583355_100000709070 [0,2,0,0,0,0|1,0,0]=3 1496 B14R2.1078 COc1cccc2c1ncnc2O 271570a_203496583355_100012001261 [0,2,0,0,0,0|2,0,0]=4 1497 B14R2.1078 COc1ccnc2c1cccc2F 34a_100000709910_200000210301 [0,2,0,0,0,0|2,0,0]=4 1498 B14R2.1078 CSc1cccc2c1cccc2F 62a_100009817034_200000210301 [0,2,0,0,0,0|2,0,0]=4 1499 B14R2.1078 CSc1cccc2c1cccc2F 62a_200000210301_100009817034 [0,2,0,0,0,0|2,0,0]=4 1500 B14R2.1078 CSc1cccc2c1cccc2N 62a_100009816864_200000210301 [0,2,0,0,0,0|2,0,0]=4 1501 B14R2.1078 CSc1cccc2c1cccc2O 62a_200000210301_100010003857 [0,2,0,0,0,0|2,0,0]=4 1502 B14R2.1078 CSc1cccc2c1nccc2C 62a_200000210301_100010254272 [0,2,0,0,0,0|1,0,0]=3 1503 B14R2.1078 CSc1cccc2c1nccc2N 62a_100011620713_200000210301 [0,2,0,0,0,0|1,0,0]=3 1504 B14R2.1078 CSc1cccc2c1nccc2N 62a_200000210301_100011620713 [0,2,0,0,0,0|1,0,0]=3 1505 B14R2.1078 CSc1cccc2c1ncnc2Cl 62a_200000210301_100010219103 [0,2,0,0,0,0|2,0,0]=4 1506 B14R2.1078 CSc1cccc2c1ncnc2N 62a_100010199759_200000210301 [0,2,0,0,0,0|2,0,0]=4 1507 B14R2.1078 CSc1cccc2c1ncnc2N 62a_200000210301_100010199759 [0,2,0,0,0,0|2,0,0]=4 1508 B14R2.1078 CSc1cccc2c1ncnc2O 62a_200000210301_100010201916 [0,2,0,0,0,0|2,0,0]=4 1509 B14R2.1078 CSc1ccnc2c1cccc2C 62a_200000210301_100000751276 [0,2,0,0,0,0|1,0,0]=3 1510 B14R2.1078 CSc1ccnc2c1cccc2F 62a_100011934723_200000210301 [0,2,0,0,0,0|2,0,0]=4 1511 B14R2.1078 CSc1ccnc2c1cccc2F 62a_200000210301_100011934723 [0,2,0,0,0,0|2,0,0]=4 1512 B14R2.1078 CSc1ccnc2c1cccc2N 62a_200000210301_100009892510 [0,2,0,0,0,0|2,0,0]=4 1513 B14R2.1078 CSc1ccnc2c1cccc2O 62a_200000210301_100000703299 [0,2,0,0,0,0|2,0,0]=4 1514 B14R2.1078 CSc1ccnc2c1nccc2C 62a_200000210301_200013369187 [0,2,0,0,0,0|2,0,0]=4 1515 B14R2.1078 CSc1ncnc2c1cccc2C 62a_200000210301_100000751292 [0,2,0,0,0,0|2,0,0]=4 1516 B14R2.1078 C[n+]1cccc2c1cccc2N[13CH3] 34a_200021579679_200025704644 [0,2,0,0,0,0|1,0,1]=4 1517 B14R2.1078 Cc1cccc2c1nccc2S[13CH3] 62a_200025704644_100000751276 [0,2,0,0,0,0|1,0,0]=3 1518 B14R2.1078 Cc1cccc2c1ncnc2S[13CH3] 62a_200025704644_100000751292 [0,2,0,0,0,0|2,0,0]=4 1519 B14R2.1078 Cc1ccnc2c1cccc2N[13CH3] 34a_100011934384_200025704644 [0,2,0,0,0,0|1,0,0]=3 1520 B14R2.1078 Cc1ccnc2c1cccc2O[13CH3] 7a_100000702989_200025704644 [0,2,0,0,0,0|1,0,0]=3 1521 B14R2.1078 Cc1ccnc2c1cccc2S[13CH3] 62a_200025704644_100010254272 [0,2,0,0,0,0|1,0,0]=3 1522 B14R2.1078 Cc1ccnc2c1nccc2S[13CH3] 62a_200025704644_200013369187 [0,2,0,0,0,0|2,0,0]=4 1523 B14R2.1078 [13CH3]Nc1cccc2c1cccc2Br 34a_100009816864_200025704644 [0,2,0,0,0,0|2,0,0]=4 1524 B14R2.1078 [13CH3]Nc1cccc2c1cccc2Cl 34a_100000077128_200025704644 [0,2,0,0,0,0|2,0,0]=4 1525 B14R2.1078 [13CH3]Nc1cccc2c1cccc2O 34a_100000210686_200025704644 [0,2,0,0,0,0|2,0,0]=4 1526 B14R2.1078 [13CH3]Nc1cccc2c1nccc2Cl 34a_100009892510_200025704644 [0,2,0,0,0,0|1,0,0]=3 1527 B14R2.1078 [13CH3]Oc1cccc2c1cccc2Br 34a_100010003857_200025704644 [0,2,0,0,0,0|2,0,0]=4 1528 B14R2.1078 [13CH3]Oc1cccc2c1cccc2Br 7a_100010003857_200025704644 [0,2,0,0,0,0|2,0,0]=4 1529 B14R2.1078 [13CH3]Oc1cccc2c1cccc2N 34a_100000210686_200025704644 [0,2,0,0,0,0|2,0,0]=4 1530 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 34a_100000703299_200025704644 [0,2,0,0,0,0|1,0,0]=3 1531 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 7a_100000703299_200025704644 [0,2,0,0,0,0|1,0,0]=3 1532 B14R2.1078 [13CH3]Oc1ccnc2c1cccc2F 34a_100000709910_200025704644 [0,2,0,0,0,0|2,0,0]=4 1533 B14R2.1078 [13CH3]Sc1cccc2c1cccc2F 62a_100009817034_200025704644 [0,2,0,0,0,0|2,0,0]=4 1534 B14R2.1078 [13CH3]Sc1cccc2c1cccc2F 62a_200025704644_100009817034 [0,2,0,0,0,0|2,0,0]=4 1535 B14R2.1078 [13CH3]Sc1cccc2c1cccc2N 62a_100009816864_200025704644 [0,2,0,0,0,0|2,0,0]=4 1536 B14R2.1078 [13CH3]Sc1cccc2c1cccc2O 62a_200025704644_100010003857 [0,2,0,0,0,0|2,0,0]=4 1537 B14R2.1078 [13CH3]Sc1cccc2c1nccc2N 62a_100011620713_200025704644 [0,2,0,0,0,0|1,0,0]=3 1538 B14R2.1078 [13CH3]Sc1cccc2c1nccc2N 62a_200025704644_100011620713 [0,2,0,0,0,0|1,0,0]=3 1539 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2Cl 62a_200025704644_100010219103 [0,2,0,0,0,0|2,0,0]=4 1540 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2N 62a_100010199759_200025704644 [0,2,0,0,0,0|2,0,0]=4 1541 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2N 62a_200025704644_100010199759 [0,2,0,0,0,0|2,0,0]=4 1542 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2O 62a_200025704644_100010201916 [0,2,0,0,0,0|2,0,0]=4 1543 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2F 62a_100011934723_200025704644 [0,2,0,0,0,0|2,0,0]=4 1544 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2F 62a_200025704644_100011934723 [0,2,0,0,0,0|2,0,0]=4 1545 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2N 62a_200025704644_100009892510 [0,2,0,0,0,0|2,0,0]=4 1546 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2O 62a_200025704644_100000703299 [0,2,0,0,0,0|2,0,0]=4 1547 B14R2.8051 Cc1ccnc2c1c(ccc2O)C 271570a_203496583355_200010761301 [0,2,0,0,0,0|1,0,0]=3 1548 B14R2.8051 Oc1ccnc2c1c(ccc2F)F 271570a_203496583355_100000748727 [0,2,0,0,0,0|2,0,0]=4 1549 B14R2.1131 C=Cc1ccc(c2c1cccc2)C 271570a_100011290941_100011215156 [0,2,0,0,0,0|2,0,0]=4 1550 B14R2.1131 C=Cc1ccc(c2c1cccn2)C 271570a_100011290941_100000694312 [0,2,0,0,0,0|1,0,0]=3 1551 B14R2.1131 C=Cc1ccc(c2c1cccn2)F 271570a_100011290941_100010245834 [0,2,0,0,0,0|1,0,1]=4 1552 B14R2.1131 C=Cc1ccc(c2c1cccn2)N 271570a_100011290941_100000726955 [0,2,0,0,0,0|1,0,1]=4 1553 B14R2.1131 C=Cc1ccc(c2c1cccn2)O 271570a_100011290941_100011934063 [0,2,0,0,0,0|1,0,1]=4 1554 B14R2.1131 C=Cc1ccc(c2c1nccc2)F 271570a_100011290941_100010214461 [0,2,0,0,0,0|1,0,1]=4 1555 B14R2.1131 C=Cc1ccc(c2c1nccc2)N 271570a_100011290941_100012360041 [0,2,0,0,0,0|1,0,1]=4 1556 B14R2.1131 CNc1c[nH]c(=O)c2c1nccn2 27a_100102657272_100020993077 [0,2,0,0,0,0|1,0,0]=3 1557 B14R2.1131 CNc1ccc(c2c1cccc2)Br 34a_100000766797_200000210301 [0,2,0,0,0,0|2,0,0]=4 1558 B14R2.1131 CNc1ccc(c2c1cccc2)Cl 34a_100011216319_200000210301 [0,2,0,0,0,0|2,0,0]=4 1559 B14R2.1131 CNc1ccc(c2c1cccc2)F 34a_100011988692_200000210301 [0,2,0,0,0,0|2,0,0]=4 1560 B14R2.1131 CNc1ccc(c2c1cccc2)O 34a_100000705857_200000210301 [0,2,0,0,0,0|2,0,0]=4 1561 B14R2.1131 CNc1ccc(c2c1cccn2)Br 34a_100012360041_200000210301 [0,2,0,0,0,0|1,0,0]=3 1562 B14R2.1131 CNc1ccc(c2c1cccn2)C 34a_100000736242_200000210301 [0,2,0,0,0,0|1,0,0]=3 1563 B14R2.1131 CNc1ccc(c2c1cccn2)Cl 34a_100000746469_200000210301 [0,2,0,0,0,0|1,0,0]=3 1564 B14R2.1131 CNc1ccc(c2c1cccn2)F 34a_102125277280_200000210301 [0,2,0,0,0,0|1,0,0]=3 1565 B14R2.1131 CNc1ccc(c2c1cccn2)O 34a_100000188197_200000210301 [0,2,0,0,0,0|1,0,0]=3 1566 B14R2.1131 CNc1ccc(c2c1nccc2)Br 34a_100000726955_200000210301 [0,2,0,0,0,0|1,0,0]=3 1567 B14R2.1131 CNc1ccc(c2c1nccc2)Cl 34a_100000736140_200000210301 [0,2,0,0,0,0|1,0,0]=3 1568 B14R2.1131 CNc1ccc(c2c1nccc2)F 27a_100102657272_100010214461 [0,2,0,0,0,0|1,0,0]=3 1569 B14R2.1131 COc1ccc(c2c1cccc2)Br 34a_100000186334_200000210301 [0,2,0,0,0,0|2,0,0]=4 1570 B14R2.1131 COc1ccc(c2c1cccc2)Br 7a_100000186334_200000210301 [0,2,0,0,0,0|2,0,0]=4 1571 B14R2.1131 COc1ccc(c2c1cccc2)C 34a_100000074455_200000210301 [0,2,0,0,0,0|2,0,0]=4 1572 B14R2.1131 COc1ccc(c2c1cccc2)C 7a_100000074455_200000210301 [0,2,0,0,0,0|2,0,0]=4 1573 B14R2.1131 COc1ccc(c2c1cccc2)Cl 34a_100000211000_200000210301 [0,2,0,0,0,0|2,0,0]=4 1574 B14R2.1131 COc1ccc(c2c1cccc2)Cl 7a_100000211000_200000210301 [0,2,0,0,0,0|2,0,0]=4 1575 B14R2.1131 COc1ccc(c2c1cccc2)F 34a_100000100223_200000210301 [0,2,0,0,0,0|2,0,0]=4 1576 B14R2.1131 COc1ccc(c2c1cccc2)F 7a_100000100223_200000210301 [0,2,0,0,0,0|2,0,0]=4 1577 B14R2.1131 COc1ccc(c2c1cccc2)N 34a_100000705857_200000210301 [0,2,0,0,0,0|2,0,0]=4 1578 B14R2.1131 COc1ccc(c2c1cccc2)N 7a_100000705857_200000210301 [0,2,0,0,0,0|2,0,0]=4 1579 B14R2.1131 COc1ccc(c2c1cccc2)O 271570a_203496583355_100011256618 [0,2,0,0,0,0|2,0,0]=4 1580 B14R2.1131 COc1ccc(c2c1nccc2)Br 34a_100011934063_200000210301 [0,2,0,0,0,0|1,0,0]=3 1581 B14R2.1131 COc1ccc(c2c1nccc2)Br 7a_100011934063_200000210301 [0,2,0,0,0,0|1,0,0]=3 1582 B14R2.1131 COc1ccc(c2c1nccc2)C 34a_100000058672_200000210301 [0,2,0,0,0,0|1,0,0]=3 1583 B14R2.1131 COc1ccc(c2c1nccc2)C 7a_100000058672_200000210301 [0,2,0,0,0,0|1,0,0]=3 1584 B14R2.1131 COc1ccc(c2c1nccc2)Cl 34a_100000212186_200000210301 [0,2,0,0,0,0|1,0,0]=3 1585 B14R2.1131 COc1ccc(c2c1nccc2)Cl 7a_100000212186_200000210301 [0,2,0,0,0,0|1,0,0]=3 1586 B14R2.1131 COc1ccc(c2c1nccc2)F 34a_100000034212_200000210301 [0,2,0,0,0,0|1,0,0]=3 1587 B14R2.1131 COc1ccc(c2c1nccc2)F 7a_100000034212_200000210301 [0,2,0,0,0,0|1,0,0]=3 1588 B14R2.1131 COc1ccc(c2c1nccc2)N 34a_100000188197_200000210301 [0,2,0,0,0,0|1,0,0]=3 1589 B14R2.1131 COc1ccc(c2c1nccc2)O 271570a_203496583355_100009820878 [0,2,0,0,0,0|1,0,0]=3 1590 B14R2.1131 CSc1c[nH]c(=O)c2c1nccc2 62a_200000210301_100009998689 [0,2,0,0,0,0|2,0,0]=4 1591 B14R2.1131 CSc1c[nH]c(=O)c2c1nccn2 62a_200000210301_100020993077 [0,2,0,0,0,0|1,0,0]=3 1592 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_100012339872_200000210301 [0,2,0,0,0,0|2,0,0]=4 1593 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_200000210301_100012339872 [0,2,0,0,0,0|2,0,0]=4 1594 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_100011215156_200000210301 [0,2,0,0,0,0|2,0,0]=4 1595 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_200000210301_100011215156 [0,2,0,0,0,0|2,0,0]=4 1596 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_100011218216_200000210301 [0,2,0,0,0,0|2,0,0]=4 1597 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_200000210301_100011218216 [0,2,0,0,0,0|2,0,0]=4 1598 B14R2.1131 CSc1ccc(c2c1cccc2)N 62a_100000766797_200000210301 [0,2,0,0,0,0|2,0,0]=4 1599 B14R2.1131 CSc1ccc(c2c1cccc2)O 62a_200000210301_100000186334 [0,2,0,0,0,0|2,0,0]=4 1600 B14R2.1131 CSc1ccc(c2c1cccn2)C 62a_200000210301_100000694312 [0,2,0,0,0,0|1,0,0]=3 1601 B14R2.1131 CSc1ccc(c2c1cccn2)F 62a_100010245834_200000210301 [0,2,0,0,0,0|1,0,0]=3 1602 B14R2.1131 CSc1ccc(c2c1cccn2)F 62a_200000210301_100010245834 [0,2,0,0,0,0|1,0,0]=3 1603 B14R2.1131 CSc1ccc(c2c1cccn2)N 62a_100000726955_200000210301 [0,2,0,0,0,0|1,0,0]=3 1604 B14R2.1131 CSc1ccc(c2c1cccn2)N 62a_200000210301_100000726955 [0,2,0,0,0,0|1,0,0]=3 1605 B14R2.1131 CSc1ccc(c2c1cccn2)O 62a_200000210301_100011934063 [0,2,0,0,0,0|1,0,0]=3 1606 B14R2.1131 CSc1ccc(c2c1nccc2)F 62a_100010214461_200000210301 [0,2,0,0,0,0|1,0,0]=3 1607 B14R2.1131 CSc1ccc(c2c1nccc2)F 62a_200000210301_100010214461 [0,2,0,0,0,0|1,0,0]=3 1608 B14R2.1131 CSc1ccc(c2c1nccc2)N 62a_100012360041_200000210301 [0,2,0,0,0,0|1,0,0]=3 1609 B14R2.1131 CSc1ccc(c2c1nccc2)N 62a_200000210301_100012360041 [0,2,0,0,0,0|1,0,0]=3 1610 B14R2.1131 CSc1cnc(c2c1nccc2)Cl 62a_200000210301_200010218400 [0,2,0,0,0,0|2,0,0]=4 1611 B14R2.1131 CSc1cnc(c2c1nccc2)N 62a_100010383929_200000210301 [0,2,0,0,0,0|2,0,0]=4 1612 B14R2.1131 CSc1cnc(c2c1nccc2)N 62a_200000210301_100010383929 [0,2,0,0,0,0|2,0,0]=4 1613 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 34a_100000074455_200025704644 [0,2,0,0,0,0|2,0,0]=4 1614 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 7a_100000074455_200025704644 [0,2,0,0,0,0|2,0,0]=4 1615 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_100011215156_200025704644 [0,2,0,0,0,0|2,0,0]=4 1616 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_200025704644_100011215156 [0,2,0,0,0,0|2,0,0]=4 1617 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 34a_100000058672_200025704644 [0,2,0,0,0,0|1,0,0]=3 1618 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 7a_100000058672_200025704644 [0,2,0,0,0,0|1,0,0]=3 1619 B14R2.1131 Cc1ccc(c2c1nccc2)N[13CH3] 34a_100000736242_200025704644 [0,2,0,0,0,0|1,0,0]=3 1620 B14R2.1131 Cc1ccc(c2c1nccc2)S[13CH3] 62a_200025704644_100000694312 [0,2,0,0,0,0|1,0,0]=3 1621 B14R2.1131 N#Cc1ccc(c2c1nccc2)O 271570a_203496583355_100012663090 [0,2,0,0,0,0|1,0,1]=4 1622 B14R2.1131 NCc1ccc(c2c1cccc2)O 271570a_203496583355_100016995114 [0,2,0,0,0,0|2,0,0]=4 1623 B14R2.1131 O=Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694311 [0,2,0,0,0,0|1,0,1]=4 1624 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Br 34a_100000766797_200025704644 [0,2,0,0,0,0|2,0,0]=4 1625 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Cl 34a_100011216319_200025704644 [0,2,0,0,0,0|2,0,0]=4 1626 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)F 34a_100011988692_200025704644 [0,2,0,0,0,0|2,0,0]=4 1627 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)O 34a_100000705857_200025704644 [0,2,0,0,0,0|2,0,0]=4 1628 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)Br 34a_100012360041_200025704644 [0,2,0,0,0,0|1,0,0]=3 1629 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)Cl 34a_100000746469_200025704644 [0,2,0,0,0,0|1,0,0]=3 1630 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)F 34a_102125277280_200025704644 [0,2,0,0,0,0|1,0,0]=3 1631 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)O 34a_100000188197_200025704644 [0,2,0,0,0,0|1,0,0]=3 1632 B14R2.1131 [13CH3]Nc1ccc(c2c1nccc2)Br 34a_100000726955_200025704644 [0,2,0,0,0,0|1,0,0]=3 1633 B14R2.1131 [13CH3]Nc1ccc(c2c1nccc2)Cl 34a_100000736140_200025704644 [0,2,0,0,0,0|1,0,0]=3 1634 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 34a_100000186334_200025704644 [0,2,0,0,0,0|2,0,0]=4 1635 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 7a_100000186334_200025704644 [0,2,0,0,0,0|2,0,0]=4 1636 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 34a_100000211000_200025704644 [0,2,0,0,0,0|2,0,0]=4 1637 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 7a_100000211000_200025704644 [0,2,0,0,0,0|2,0,0]=4 1638 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 34a_100000100223_200025704644 [0,2,0,0,0,0|2,0,0]=4 1639 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 7a_100000100223_200025704644 [0,2,0,0,0,0|2,0,0]=4 1640 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 34a_100000705857_200025704644 [0,2,0,0,0,0|2,0,0]=4 1641 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 7a_100000705857_200025704644 [0,2,0,0,0,0|2,0,0]=4 1642 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Br 34a_100011934063_200025704644 [0,2,0,0,0,0|1,0,0]=3 1643 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Br 7a_100011934063_200025704644 [0,2,0,0,0,0|1,0,0]=3 1644 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Cl 34a_100000212186_200025704644 [0,2,0,0,0,0|1,0,0]=3 1645 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Cl 7a_100000212186_200025704644 [0,2,0,0,0,0|1,0,0]=3 1646 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)F 34a_100000034212_200025704644 [0,2,0,0,0,0|1,0,0]=3 1647 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)F 7a_100000034212_200025704644 [0,2,0,0,0,0|1,0,0]=3 1648 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)N 34a_100000188197_200025704644 [0,2,0,0,0,0|1,0,0]=3 1649 B14R2.1131 [13CH3]Sc1c[nH]c(=O)c2c1nccc2 62a_200025704644_100009998689 [0,2,0,0,0,0|2,0,0]=4 1650 B14R2.1131 [13CH3]Sc1c[nH]c(=O)c2c1nccn2 62a_200025704644_100020993077 [0,2,0,0,0,0|1,0,0]=3 1651 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_100012339872_200025704644 [0,2,0,0,0,0|2,0,0]=4 1652 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_200025704644_100012339872 [0,2,0,0,0,0|2,0,0]=4 1653 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_100011218216_200025704644 [0,2,0,0,0,0|2,0,0]=4 1654 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_200025704644_100011218216 [0,2,0,0,0,0|2,0,0]=4 1655 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)N 62a_100000766797_200025704644 [0,2,0,0,0,0|2,0,0]=4 1656 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)O 62a_200025704644_100000186334 [0,2,0,0,0,0|2,0,0]=4 1657 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)F 62a_100010245834_200025704644 [0,2,0,0,0,0|1,0,0]=3 1658 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)F 62a_200025704644_100010245834 [0,2,0,0,0,0|1,0,0]=3 1659 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)N 62a_100000726955_200025704644 [0,2,0,0,0,0|1,0,0]=3 1660 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)N 62a_200025704644_100000726955 [0,2,0,0,0,0|1,0,0]=3 1661 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)O 62a_200025704644_100011934063 [0,2,0,0,0,0|1,0,0]=3 1662 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)F 62a_100010214461_200025704644 [0,2,0,0,0,0|1,0,0]=3 1663 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)F 62a_200025704644_100010214461 [0,2,0,0,0,0|1,0,0]=3 1664 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)N 62a_100012360041_200025704644 [0,2,0,0,0,0|1,0,0]=3 1665 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)N 62a_200025704644_100012360041 [0,2,0,0,0,0|1,0,0]=3 1666 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)Cl 62a_200025704644_200010218400 [0,2,0,0,0,0|2,0,0]=4 1667 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)N 62a_100010383929_200025704644 [0,2,0,0,0,0|2,0,0]=4 1668 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)N 62a_200025704644_100010383929 [0,2,0,0,0,0|2,0,0]=4 1669 B14R2.1073 C=Cc1cccc2c1ccc(n2)C 271570a_100011290941_100010173736 [0,2,0,0,0,0|1,0,1]=4 1670 B14R2.1073 C=Cc1cccc2c1ccc(n2)N 271570a_100011290941_100000723655 [0,2,0,0,0,0|1,0,1]=4 1671 B14R2.1073 CNc1cccc2c1ccc(c2)Br 34a_100010090037_200000210301 [0,2,0,0,0,0|2,0,0]=4 1672 B14R2.1073 CNc1cccc2c1ccc(c2)O 34a_100000034668_200000210301 [0,2,0,0,0,0|2,0,0]=4 1673 B14R2.1073 CNc1cccc2c1ccc(n2)C 27a_100102657272_100010173736 [0,2,0,0,0,0|1,0,0]=3 1674 B14R2.1073 CNc1cccc2c1ccc(n2)C 34a_106741707140_200000210301 [0,2,0,0,0,0|1,0,0]=3 1675 B14R2.1073 CNc1cccc2c1cnc(n2)N 27a_100102657272_100010209551 [0,2,0,0,0,0|2,0,0]=4 1676 B14R2.1073 CNc1cccc2c1ncc(c2)Br 34a_100000702407_200000210301 [0,2,0,0,0,0|1,0,0]=3 1677 B14R2.1073 CNc1ccnc2c1ncc(c2)F 27a_100102657272_100011072215 [0,2,0,0,0,0|2,0,0]=4 1678 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 1679 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 1680 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 1681 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 1682 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [0,2,0,0,0,0|2,0,0]=4 1683 B14R2.1073 COc1cccc2c1ccc(n2)O 271570a_203496583355_100010382897 [0,2,0,0,0,0|1,0,0]=3 1684 B14R2.1073 COc1cccc2c1ncc(c2)C 34a_100000144662_200000210301 [0,2,0,0,0,0|1,0,0]=3 1685 B14R2.1073 COc1cccc2c1ncc(c2)C 7a_100000144662_200000210301 [0,2,0,0,0,0|1,0,0]=3 1686 B14R2.1073 COc1cccc2c1ncc(c2)Cl 34a_100009858588_200000210301 [0,2,0,0,0,0|1,0,0]=3 1687 B14R2.1073 COc1cccc2c1ncc(c2)Cl 7a_100009858588_200000210301 [0,2,0,0,0,0|1,0,0]=3 1688 B14R2.1073 COc1cccc2c1ncc(n2)O 271570a_203496583355_100010890105 [0,2,0,0,0,0|0,0,0]=2 1689 B14R2.1073 COc1nccc2c1ncc(c2)Br 34a_100010117065_200000210301 [0,2,0,0,0,0|2,0,0]=4 1690 B14R2.1073 CSc1cccc2c1ccc(=O)[nH]2 62a_200000210301_100000726145 [0,2,0,0,0,0|1,0,1]=4 1691 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_100010173736_200000210301 [0,2,0,0,0,0|1,0,0]=3 1692 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_200000210301_100010173736 [0,2,0,0,0,0|1,0,0]=3 1693 B14R2.1073 CSc1cccc2c1ccc(n2)N 62a_100000723655_200000210301 [0,2,0,0,0,0|1,0,0]=3 1694 B14R2.1073 CSc1cccc2c1cnc(n2)N 62a_100010209551_200000210301 [0,2,0,0,0,0|2,0,0]=4 1695 B14R2.1073 CSc1cccc2c1cnc(n2)N 62a_200000210301_100010209551 [0,2,0,0,0,0|2,0,0]=4 1696 B14R2.1073 CSc1ccnc2c1ncc(c2)F 62a_100011072215_200000210301 [0,2,0,0,0,0|2,0,0]=4 1697 B14R2.1073 CSc1ccnc2c1ncc(c2)F 62a_200000210301_100011072215 [0,2,0,0,0,0|2,0,0]=4 1698 B14R2.1073 Cc1ccc2c(cccc2n1)N[13CH3] 34a_106741707140_200025704644 [0,2,0,0,0,0|1,0,0]=3 1699 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_100010173736_200025704644 [0,2,0,0,0,0|1,0,0]=3 1700 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_200025704644_100010173736 [0,2,0,0,0,0|1,0,0]=3 1701 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 34a_100000144662_200025704644 [0,2,0,0,0,0|1,0,0]=3 1702 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 7a_100000144662_200025704644 [0,2,0,0,0,0|1,0,0]=3 1703 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)Br 34a_100010090037_200025704644 [0,2,0,0,0,0|2,0,0]=4 1704 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)O 34a_100000034668_200025704644 [0,2,0,0,0,0|2,0,0]=4 1705 B14R2.1073 [13CH3]Nc1cccc2c1ncc(c2)Br 34a_100000702407_200025704644 [0,2,0,0,0,0|1,0,0]=3 1706 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 1707 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 1708 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 1709 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 1710 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [0,2,0,0,0,0|2,0,0]=4 1711 B14R2.1073 [13CH3]Oc1cccc2c1ncc(c2)Cl 34a_100009858588_200025704644 [0,2,0,0,0,0|1,0,0]=3 1712 B14R2.1073 [13CH3]Oc1cccc2c1ncc(c2)Cl 7a_100009858588_200025704644 [0,2,0,0,0,0|1,0,0]=3 1713 B14R2.1073 [13CH3]Oc1nccc2c1ncc(c2)Br 34a_100010117065_200025704644 [0,2,0,0,0,0|2,0,0]=4 1714 B14R2.1073 [13CH3]Sc1cccc2c1ccc(=O)[nH]2 62a_200025704644_100000726145 [0,2,0,0,0,0|1,0,1]=4 1715 B14R2.1073 [13CH3]Sc1cccc2c1ccc(n2)N 62a_100000723655_200025704644 [0,2,0,0,0,0|1,0,0]=3 1716 B14R2.1073 [13CH3]Sc1cccc2c1cnc(n2)N 62a_100010209551_200025704644 [0,2,0,0,0,0|2,0,0]=4 1717 B14R2.1073 [13CH3]Sc1cccc2c1cnc(n2)N 62a_200025704644_100010209551 [0,2,0,0,0,0|2,0,0]=4 1718 B14R2.1073 [13CH3]Sc1ccnc2c1ncc(c2)F 62a_100011072215_200025704644 [0,2,0,0,0,0|2,0,0]=4 1719 B14R2.1073 [13CH3]Sc1ccnc2c1ncc(c2)F 62a_200025704644_100011072215 [0,2,0,0,0,0|2,0,0]=4 1720 B14R2.7150 C=C=Cc1cccc2c1cccn2 271570a_100015277604_100011290932 [0,2,0,0,0,0|1,0,1]=4 1721 B14R2.7150 C=C=Cc1cccc2c1nccc2 271570a_100015277604_100011215545 [0,2,0,0,0,0|1,0,1]=4 1722 B14R2.7150 C=C=Cc1cccc2c1nccn2 271570a_100015277604_100010003881 [0,2,0,0,0,0|0,0,1]=3 1723 B14R2.7150 C=C=Cc1ccnc2c1nccn2 271570a_100015277604_100010783457 [0,2,0,0,0,0|1,0,1]=4 1724 B14R2.7150 C=C=Cc1cncc2c1nccn2 271570a_100015277604_200010209543 [0,2,0,0,0,0|1,0,1]=4 1725 B14R2.7150 C=C=Cc1nccc2c1nccn2 271570a_100015277604_100010063732 [0,2,0,0,0,0|1,0,1]=4 1726 B14R2.7150 CC=Cc1cccc2c1cccc2 271570a_100016259895_100000210605 [0,2,0,0,0,0|2,0,0]=4 1727 B14R2.7150 CC=Cc1cccc2c1cccn2 271570a_100016259895_100011290932 [0,2,0,0,0,0|1,0,0]=3 1728 B14R2.7150 CC=Cc1cccc2c1cncn2 271570a_100016259895_100009814520 [0,2,0,0,0,0|2,0,0]=4 1729 B14R2.7150 CC=Cc1cccc2c1nccc2 271570a_100016259895_100011215545 [0,2,0,0,0,0|1,0,0]=3 1730 B14R2.7150 CC=Cc1cccc2c1nccn2 271570a_100016259895_100010003881 [0,2,0,0,0,0|0,0,0]=2 1731 B14R2.7150 CC=Cc1cccc2c1ncnc2 271570a_100016259895_100010246313 [0,2,0,0,0,0|2,0,0]=4 1732 B14R2.7150 CC=Cc1ccnc2c1cccn2 271570a_100016259895_100000087570 [0,2,0,0,0,0|2,0,0]=4 1733 B14R2.7150 CC=Cc1ccnc2c1nccn2 271570a_100016259895_100010783457 [0,2,0,0,0,0|1,0,0]=3 1734 B14R2.7150 CC=Cc1cncc2c1cccn2 271570a_100016259895_100010211308 [0,2,0,0,0,0|2,0,0]=4 1735 B14R2.7150 CC=Cc1cncc2c1nccn2 271570a_100016259895_200010209543 [0,2,0,0,0,0|1,0,0]=3 1736 B14R2.7150 CC=Cc1nccc2c1cccn2 271570a_100016259895_100000077681 [0,2,0,0,0,0|2,0,0]=4 1737 B14R2.7150 CC=Cc1nccc2c1nccc2 271570a_100016259895_100010063729 [0,2,0,0,0,0|2,0,0]=4 1738 B14R2.7150 CC=Cc1nccc2c1nccn2 271570a_100016259895_100010063732 [0,2,0,0,0,0|1,0,0]=3 1739 B14R2.7150 CCNc1cccc2c1cccc2 34a_100000185869_100000210202 [0,2,0,0,0,0|2,0,0]=4 1740 B14R2.7150 CCNc1cccc2c1cccn2 27a_100015525214_100011290932 [0,2,0,0,0,0|1,0,0]=3 1741 B14R2.7150 CCNc1cccc2c1cccn2 34a_100000183906_100000210202 [0,2,0,0,0,0|1,0,0]=3 1742 B14R2.7150 CCNc1cccc2c1cncn2 27a_100015525214_100009814520 [0,2,0,0,0,0|2,0,0]=4 1743 B14R2.7150 CCNc1cccc2c1nccc2 34a_100000181377_100000210202 [0,2,0,0,0,0|1,0,0]=3 1744 B14R2.7150 CCNc1cccc2c1nccn2 27a_100015525214_100010003881 [0,2,0,0,0,0|0,0,0]=2 1745 B14R2.7150 CCNc1cccc2c1ncnc2 27a_100015525214_100010246313 [0,2,0,0,0,0|2,0,0]=4 1746 B14R2.7150 CCNc1ccnc2c1cccn2 27a_100015525214_100000087570 [0,2,0,0,0,0|2,0,0]=4 1747 B14R2.7150 CCNc1ccnc2c1nccn2 27a_100015525214_100010783457 [0,2,0,0,0,0|1,0,0]=3 1748 B14R2.7150 CCNc1cncc2c1cccn2 27a_100015525214_100010211308 [0,2,0,0,0,0|2,0,0]=4 1749 B14R2.7150 CCNc1cncc2c1nccn2 27a_100015525214_200010209543 [0,2,0,0,0,0|1,0,0]=3 1750 B14R2.7150 CCNc1nccc2c1cccn2 27a_100015525214_100000077681 [0,2,0,0,0,0|2,0,0]=4 1751 B14R2.7150 CCNc1nccc2c1nccc2 27a_100015525214_100010063729 [0,2,0,0,0,0|2,0,0]=4 1752 B14R2.7150 CCNc1nccc2c1nccn2 27a_100015525214_100010063732 [0,2,0,0,0,0|1,0,0]=3 1753 B14R2.7150 CCOc1cccc2c1CC=CC2 34a_100000074931_100000210202 [0,2,0,0,0,0|2,0,0]=4 1754 B14R2.7150 CCOc1cccc2c1CC=CC2 7a_100000074931_100000210202 [0,2,0,0,0,0|2,0,0]=4 1755 B14R2.7150 CCOc1cccc2c1cccc2 34a_100000210388_100000210202 [0,2,0,0,0,0|2,0,0]=4 1756 B14R2.7150 CCOc1cccc2c1cccc2 7a_100000210388_100000210202 [0,2,0,0,0,0|2,0,0]=4 1757 B14R2.7150 CCOc1cccc2c1cccn2 34a_100011197808_100000210202 [0,2,0,0,0,0|1,0,0]=3 1758 B14R2.7150 CCOc1cccc2c1nccc2 34a_100000056035_100000210202 [0,2,0,0,0,0|1,0,0]=3 1759 B14R2.7150 CCOc1cccc2c1nccn2 34a_100000077048_100000210202 [0,2,0,0,0,0|0,0,0]=2 1760 B14R2.7150 CCOc1cccc2c1ncnc2 34a_200000077003_100000210202 [0,2,0,0,0,0|2,0,0]=4 1761 B14R2.7150 CCSc1cccc2c1cccc2 62a_100000210202_100000210605 [0,2,0,0,0,0|2,0,0]=4 1762 B14R2.7150 CCSc1cccc2c1cccn2 62a_100000210202_100011290932 [0,2,0,0,0,0|1,0,0]=3 1763 B14R2.7150 CCSc1cccc2c1cccn2 62a_100011290932_100000210202 [0,2,0,0,0,0|1,0,0]=3 1764 B14R2.7150 CCSc1cccc2c1cncn2 62a_100000210202_100009814520 [0,2,0,0,0,0|2,0,0]=4 1765 B14R2.7150 CCSc1cccc2c1cncn2 62a_100009814520_100000210202 [0,2,0,0,0,0|2,0,0]=4 1766 B14R2.7150 CCSc1cccc2c1nccc2 62a_100000210202_100011215545 [0,2,0,0,0,0|1,0,0]=3 1767 B14R2.7150 CCSc1cccc2c1nccn2 62a_100000210202_100010003881 [0,2,0,0,0,0|0,0,0]=2 1768 B14R2.7150 CCSc1cccc2c1nccn2 62a_100010003881_100000210202 [0,2,0,0,0,0|0,0,0]=2 1769 B14R2.7150 CCSc1cccc2c1ncnc2 62a_100000210202_100010246313 [0,2,0,0,0,0|2,0,0]=4 1770 B14R2.7150 CCSc1cccc2c1ncnc2 62a_100010246313_100000210202 [0,2,0,0,0,0|2,0,0]=4 1771 B14R2.7150 CCSc1ccnc2c1cccn2 62a_100000087570_100000210202 [0,2,0,0,0,0|2,0,0]=4 1772 B14R2.7150 CCSc1ccnc2c1cccn2 62a_100000210202_100000087570 [0,2,0,0,0,0|2,0,0]=4 1773 B14R2.7150 CCSc1ccnc2c1nccn2 62a_100000210202_100010783457 [0,2,0,0,0,0|1,0,0]=3 1774 B14R2.7150 CCSc1ccnc2c1nccn2 62a_100010783457_100000210202 [0,2,0,0,0,0|1,0,0]=3 1775 B14R2.7150 CCSc1cncc2c1cccn2 62a_100000210202_100010211308 [0,2,0,0,0,0|2,0,0]=4 1776 B14R2.7150 CCSc1cncc2c1cccn2 62a_100010211308_100000210202 [0,2,0,0,0,0|2,0,0]=4 1777 B14R2.7150 CCSc1cncc2c1nccn2 62a_100000210202_200010209543 [0,2,0,0,0,0|1,0,0]=3 1778 B14R2.7150 CCSc1cncc2c1nccn2 62a_200010209543_100000210202 [0,2,0,0,0,0|1,0,0]=3 1779 B14R2.7150 CCSc1nccc2c1cccn2 62a_100000210202_100000077681 [0,2,0,0,0,0|2,0,0]=4 1780 B14R2.7150 CCSc1nccc2c1nccc2 62a_100000210202_100010063729 [0,2,0,0,0,0|2,0,0]=4 1781 B14R2.7150 CCSc1nccc2c1nccn2 62a_100000210202_100010063732 [0,2,0,0,0,0|1,0,0]=3 1782 B14R2.7150 CCSc1nccc2c1nccn2 62a_100010063732_100000210202 [0,2,0,0,0,0|1,0,0]=3 1783 B14R2.7150 CNCc1cccc2c1CC=CC2 26a_100102657272_100000074931 [0,2,0,0,0,0|2,0,0]=4 1784 B14R2.7150 CNCc1cccc2c1cccc2 207a_100102657272_100000210074 [0,2,0,0,0,0|2,0,0]=4 1785 B14R2.7150 CNCc1cccc2c1cccc2 2230a_106832991635_100011261445 [0,2,0,0,0,0|2,0,0]=4 1786 B14R2.7150 CNCc1cccc2c1cccc2 270004a_106832991635_100000210074 [0,2,0,0,0,0|2,0,0]=4 1787 B14R2.7150 CNCc1cccc2c1cccc2 34a_100000753325_200000210301 [0,2,0,0,0,0|2,0,0]=4 1788 B14R2.7150 CNCc1cccc2c1cccc2 34a_100102657272_100011261445 [0,2,0,0,0,0|2,0,0]=4 1789 B14R2.7150 CNCc1cccc2c1cccc2 7a_106832991635_100011261445 [0,2,0,0,0,0|2,0,0]=4 1790 B14R2.7150 CNCc1cccc2c1cccn2 207a_100102657272_100000708479 [0,2,0,0,0,0|1,0,0]=3 1791 B14R2.7150 CNCc1cccc2c1cccn2 270004a_106832991635_100000708479 [0,2,0,0,0,0|1,0,0]=3 1792 B14R2.7150 CNCc1cccc2c1nccc2 207a_100102657272_100000239888 [0,2,0,0,0,0|1,0,0]=3 1793 B14R2.7150 CNCc1cccc2c1nccc2 2230a_106832991635_100000241032 [0,2,0,0,0,0|1,0,0]=3 1794 B14R2.7150 CNCc1cccc2c1nccc2 270004a_106832991635_100000239888 [0,2,0,0,0,0|1,0,0]=3 1795 B14R2.7150 CNCc1cccc2c1nccc2 34a_100102657272_100000241032 [0,2,0,0,0,0|1,0,0]=3 1796 B14R2.7150 CNCc1cccc2c1nccc2 7a_106832991635_100000241032 [0,2,0,0,0,0|1,0,0]=3 1797 B14R2.7150 CNCc1cccc2c1nccn2 270004a_106832991635_100011996249 [0,2,0,0,0,0|0,0,0]=2 1798 B14R2.7150 COCc1cccc2c1cccc2 34a_100011216843_200000210301 [0,2,0,0,0,0|2,0,0]=4 1799 B14R2.7150 COCc1cccc2c1cccc2 34a_100138415774_100011261445 [0,2,0,0,0,0|2,0,0]=4 1800 B14R2.7150 COCc1cccc2c1cccc2 7a_100011216843_200000210301 [0,2,0,0,0,0|2,0,0]=4 1801 B14R2.7150 COCc1cccc2c1cccn2 34a_100000709871_200000210301 [0,2,0,0,0,0|1,0,0]=3 1802 B14R2.7150 COCc1cccc2c1nccc2 34a_100011303629_200000210301 [0,2,0,0,0,0|1,0,0]=3 1803 B14R2.7150 COCc1cccc2c1nccc2 34a_100138415774_100000241032 [0,2,0,0,0,0|1,0,0]=3 1804 B14R2.7150 CSCc1cccc2c1cccc2 62a_100011261445_200000210301 [0,2,0,0,0,0|2,0,0]=4 1805 B14R2.7150 CSCc1cccc2c1cccc2 62a_200000210301_100000188474 [0,2,0,0,0,0|2,0,0]=4 1806 B14R2.7150 CSCc1cccc2c1nccc2 62a_200000210301_100000241032 [0,2,0,0,0,0|1,0,0]=3 1807 B14R2.7150 FCNc1cccc2c1cccc2 34a_100000185869_100015361967 [0,2,0,0,0,0|2,0,0]=4 1808 B14R2.7150 FCNc1cccc2c1cccn2 34a_100000183906_100015361967 [0,2,0,0,0,0|1,0,0]=3 1809 B14R2.7150 FCNc1cccc2c1nccc2 34a_100000181377_100015361967 [0,2,0,0,0,0|1,0,0]=3 1810 B14R2.7150 FCOc1cccc2c1CC=CC2 34a_100000074931_100015361967 [0,2,0,0,0,0|2,0,0]=4 1811 B14R2.7150 FCOc1cccc2c1CC=CC2 7a_100000074931_100015361967 [0,2,0,0,0,0|2,0,0]=4 1812 B14R2.7150 FCOc1cccc2c1cccc2 34a_100000210388_100015361967 [0,2,0,0,0,0|2,0,0]=4 1813 B14R2.7150 FCOc1cccc2c1cccc2 7a_100000210388_100015361967 [0,2,0,0,0,0|2,0,0]=4 1814 B14R2.7150 FCOc1cccc2c1cccn2 34a_100011197808_100015361967 [0,2,0,0,0,0|1,0,0]=3 1815 B14R2.7150 FCOc1cccc2c1nccc2 34a_100000056035_100015361967 [0,2,0,0,0,0|1,0,0]=3 1816 B14R2.7150 FCOc1cccc2c1nccn2 34a_100000077048_100015361967 [0,2,0,0,0,0|0,0,0]=2 1817 B14R2.7150 FCOc1cccc2c1ncnc2 34a_200000077003_100015361967 [0,2,0,0,0,0|2,0,0]=4 1818 B14R2.7150 FCSc1cccc2c1cccc2 62a_100015361967_100000210605 [0,2,0,0,0,0|2,0,0]=4 1819 B14R2.7150 FCSc1cccc2c1cccn2 62a_100011290932_100015361967 [0,2,0,0,0,0|1,0,0]=3 1820 B14R2.7150 FCSc1cccc2c1cccn2 62a_100015361967_100011290932 [0,2,0,0,0,0|1,0,0]=3 1821 B14R2.7150 FCSc1cccc2c1cncn2 62a_100009814520_100015361967 [0,2,0,0,0,0|2,0,0]=4 1822 B14R2.7150 FCSc1cccc2c1cncn2 62a_100015361967_100009814520 [0,2,0,0,0,0|2,0,0]=4 1823 B14R2.7150 FCSc1cccc2c1nccc2 62a_100015361967_100011215545 [0,2,0,0,0,0|1,0,0]=3 1824 B14R2.7150 FCSc1cccc2c1nccn2 62a_100010003881_100015361967 [0,2,0,0,0,0|0,0,0]=2 1825 B14R2.7150 FCSc1cccc2c1nccn2 62a_100015361967_100010003881 [0,2,0,0,0,0|0,0,0]=2 1826 B14R2.7150 FCSc1cccc2c1ncnc2 62a_100010246313_100015361967 [0,2,0,0,0,0|2,0,0]=4 1827 B14R2.7150 FCSc1cccc2c1ncnc2 62a_100015361967_100010246313 [0,2,0,0,0,0|2,0,0]=4 1828 B14R2.7150 FCSc1ccnc2c1cccn2 62a_100000087570_100015361967 [0,2,0,0,0,0|2,0,0]=4 1829 B14R2.7150 FCSc1ccnc2c1cccn2 62a_100015361967_100000087570 [0,2,0,0,0,0|2,0,0]=4 1830 B14R2.7150 FCSc1ccnc2c1nccn2 62a_100010783457_100015361967 [0,2,0,0,0,0|1,0,0]=3 1831 B14R2.7150 FCSc1ccnc2c1nccn2 62a_100015361967_100010783457 [0,2,0,0,0,0|1,0,0]=3 1832 B14R2.7150 FCSc1cncc2c1cccn2 62a_100010211308_100015361967 [0,2,0,0,0,0|2,0,0]=4 1833 B14R2.7150 FCSc1cncc2c1cccn2 62a_100015361967_100010211308 [0,2,0,0,0,0|2,0,0]=4 1834 B14R2.7150 FCSc1cncc2c1nccn2 62a_100015361967_200010209543 [0,2,0,0,0,0|1,0,0]=3 1835 B14R2.7150 FCSc1cncc2c1nccn2 62a_200010209543_100015361967 [0,2,0,0,0,0|1,0,0]=3 1836 B14R2.7150 FCSc1nccc2c1cccn2 62a_100015361967_100000077681 [0,2,0,0,0,0|2,0,0]=4 1837 B14R2.7150 FCSc1nccc2c1nccc2 62a_100015361967_100010063729 [0,2,0,0,0,0|2,0,0]=4 1838 B14R2.7150 FCSc1nccc2c1nccn2 62a_100010063732_100015361967 [0,2,0,0,0,0|1,0,0]=3 1839 B14R2.7150 FCSc1nccc2c1nccn2 62a_100015361967_100010063732 [0,2,0,0,0,0|1,0,0]=3 1840 B14R2.7150 [13CH3]NCc1cccc2c1cccc2 34a_100000753325_200025704644 [0,2,0,0,0,0|2,0,0]=4 1841 B14R2.7150 [13CH3]OCc1cccc2c1cccc2 34a_100011216843_200025704644 [0,2,0,0,0,0|2,0,0]=4 1842 B14R2.7150 [13CH3]OCc1cccc2c1cccc2 7a_100011216843_200025704644 [0,2,0,0,0,0|2,0,0]=4 1843 B14R2.7150 [13CH3]OCc1cccc2c1cccn2 34a_100000709871_200025704644 [0,2,0,0,0,0|1,0,0]=3 1844 B14R2.7150 [13CH3]OCc1cccc2c1nccc2 34a_100011303629_200025704644 [0,2,0,0,0,0|1,0,0]=3 1845 B14R2.7150 [13CH3]SCc1cccc2c1cccc2 62a_100011261445_200025704644 [0,2,0,0,0,0|2,0,0]=4 1846 B14R2.7150 [13CH3]SCc1cccc2c1cccc2 62a_200025704644_100000188474 [0,2,0,0,0,0|2,0,0]=4 1847 B14R2.7150 [13CH3]SCc1cccc2c1nccc2 62a_200025704644_100000241032 [0,2,0,0,0,0|1,0,0]=3 1848 B14R2.11635 C=Cc1cccc2c1c(ccc2)C 271570a_100011290941_100009995290 [0,2,0,0,0,0|2,0,0]=4 1849 B14R2.11635 C=Cc1cccc2c1c(ccn2)O 271570a_100011290941_100010187735 [0,2,0,0,0,0|1,0,1]=4 1850 B14R2.11635 C=Cc1ccnc2c1c(ccc2)N 271570a_100011290941_100010263589 [0,2,0,0,0,0|2,0,0]=4 1851 B14R2.11635 CCc1cccc2c1c(ccc2)O 271570a_203496583355_202517441601 [0,2,0,0,0,0|2,0,0]=4 1852 B14R2.11635 CNc1cccc2c1[n+](ccc2)[O-] 34a_200000070183_200000210301 [0,2,0,0,0,0|1,0,1]=4 1853 B14R2.11635 CNc1cccc2c1c(=O)[nH]cn2 27a_100102657272_100000696754 [0,2,0,0,0,0|2,0,0]=4 1854 B14R2.11635 CNc1cccc2c1c(ccc2)Br 34a_100010002837_200000210301 [0,2,0,0,0,0|2,0,0]=4 1855 B14R2.11635 CNc1cccc2c1c(ccc2)C 34a_100009841044_200000210301 [0,2,0,0,0,0|2,0,0]=4 1856 B14R2.11635 CNc1cccc2c1c(ccc2)C 7a_100009841044_200000210301 [0,2,0,0,0,0|2,0,0]=4 1857 B14R2.11635 CNc1cccc2c1c(ccc2)Cl 34a_100009857565_200000210301 [0,2,0,0,0,0|2,0,0]=4 1858 B14R2.11635 CNc1cccc2c1c(ccc2)F 34a_100009878580_200000210301 [0,2,0,0,0,0|2,0,0]=4 1859 B14R2.11635 CNc1cccc2c1c(ccc2)F 7a_100009878580_200000210301 [0,2,0,0,0,0|2,0,0]=4 1860 B14R2.11635 CNc1cccc2c1c(ccn2)Cl 34a_100010263589_200000210301 [0,2,0,0,0,0|1,0,0]=3 1861 B14R2.11635 CNc1cccc2c1c(ncn2)N 27a_100102657272_100010171649 [0,2,0,0,0,0|2,0,0]=4 1862 B14R2.11635 CNc1ccnc2c1c(ccc2)N 27a_100102657272_100010263589 [0,2,0,0,0,0|2,0,0]=4 1863 B14R2.11635 COc1cccc2c1[n+](ccc2)[O-] 34a_100000039631_200000210301 [0,2,0,0,0,0|1,0,1]=4 1864 B14R2.11635 COc1cccc2c1[n+](ccc2)[O-] 7a_100000039631_200000210301 [0,2,0,0,0,0|1,0,1]=4 1865 B14R2.11635 COc1cccc2c1c(=O)cco2 34a_100000040341_200000210301 [0,2,0,0,0,0|2,0,0]=4 1866 B14R2.11635 COc1cccc2c1c(=O)cco2 7a_100000040341_200000210301 [0,2,0,0,0,0|2,0,0]=4 1867 B14R2.11635 COc1cccc2c1c(ccc2)Br 34a_100010089961_200000210301 [0,2,0,0,0,0|2,0,0]=4 1868 B14R2.11635 COc1cccc2c1c(ccc2)Br 7a_100010089961_200000210301 [0,2,0,0,0,0|2,0,0]=4 1869 B14R2.11635 COc1cccc2c1c(ccc2)O 271570a_203496583355_100010152499 [0,2,0,0,0,0|2,0,0]=4 1870 B14R2.11635 COc1cccc2c1c(ccn2)O 271570a_203496583355_100010204250 [0,2,0,0,0,0|1,0,0]=3 1871 B14R2.11635 COc1ccnc2c1c(ccc2)Br 34a_100010187735_200000210301 [0,2,0,0,0,0|2,0,0]=4 1872 B14R2.11635 COc1ccnc2c1c(ccc2)C 34a_100000087318_200000210301 [0,2,0,0,0,0|1,0,0]=3 1873 B14R2.11635 CSc1cccc2c1c(=O)[nH]cn2 62a_200000210301_100000696754 [0,2,0,0,0,0|2,0,0]=4 1874 B14R2.11635 CSc1cccc2c1c(ccc2)Br 62a_100010243825_200000210301 [0,2,0,0,0,0|2,0,0]=4 1875 B14R2.11635 CSc1cccc2c1c(ccc2)Br 62a_200000210301_100010243825 [0,2,0,0,0,0|2,0,0]=4 1876 B14R2.11635 CSc1cccc2c1c(ccc2)C 62a_200000210301_100009995290 [0,2,0,0,0,0|2,0,0]=4 1877 B14R2.11635 CSc1cccc2c1c(ccc2)F 62a_100010177852_200000210301 [0,2,0,0,0,0|2,0,0]=4 1878 B14R2.11635 CSc1cccc2c1c(ccc2)F 62a_200000210301_100010177852 [0,2,0,0,0,0|2,0,0]=4 1879 B14R2.11635 CSc1cccc2c1c(ccc2)N 62a_100010002837_200000210301 [0,2,0,0,0,0|2,0,0]=4 1880 B14R2.11635 CSc1cccc2c1c(ccc2)O 62a_200000210301_100010089961 [0,2,0,0,0,0|2,0,0]=4 1881 B14R2.11635 CSc1cccc2c1c(ncn2)N 62a_100010171649_200000210301 [0,2,0,0,0,0|2,0,0]=4 1882 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 34a_100009841044_200025704644 [0,2,0,0,0,0|2,0,0]=4 1883 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 7a_100009841044_200025704644 [0,2,0,0,0,0|2,0,0]=4 1884 B14R2.11635 Cc1cccc2c1c(ccc2)S[13CH3] 62a_200025704644_100009995290 [0,2,0,0,0,0|2,0,0]=4 1885 B14R2.11635 Cc1cccc2c1c(ccn2)O[13CH3] 34a_100000087318_200025704644 [0,2,0,0,0,0|1,0,0]=3 1886 B14R2.11635 OCc1cccc2c1c(ccc2)O 271570a_203496583355_200009814114 [0,2,0,0,0,0|2,0,0]=4 1887 B14R2.11635 [13CH3]Nc1cccc2c1[n+](ccc2)[O-] 34a_200000070183_200025704644 [0,2,0,0,0,0|1,0,1]=4 1888 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Br 34a_100010002837_200025704644 [0,2,0,0,0,0|2,0,0]=4 1889 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Cl 34a_100009857565_200025704644 [0,2,0,0,0,0|2,0,0]=4 1890 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 34a_100009878580_200025704644 [0,2,0,0,0,0|2,0,0]=4 1891 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 7a_100009878580_200025704644 [0,2,0,0,0,0|2,0,0]=4 1892 B14R2.11635 [13CH3]Nc1cccc2c1c(ccn2)Cl 34a_100010263589_200025704644 [0,2,0,0,0,0|1,0,0]=3 1893 B14R2.11635 [13CH3]Oc1cccc2c1[n+](ccc2)[O-] 34a_100000039631_200025704644 [0,2,0,0,0,0|1,0,1]=4 1894 B14R2.11635 [13CH3]Oc1cccc2c1[n+](ccc2)[O-] 7a_100000039631_200025704644 [0,2,0,0,0,0|1,0,1]=4 1895 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 34a_100000040341_200025704644 [0,2,0,0,0,0|2,0,0]=4 1896 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 7a_100000040341_200025704644 [0,2,0,0,0,0|2,0,0]=4 1897 B14R2.11635 [13CH3]Oc1cccc2c1c(ccc2)Br 34a_100010089961_200025704644 [0,2,0,0,0,0|2,0,0]=4 1898 B14R2.11635 [13CH3]Oc1cccc2c1c(ccc2)Br 7a_100010089961_200025704644 [0,2,0,0,0,0|2,0,0]=4 1899 B14R2.11635 [13CH3]Oc1ccnc2c1c(ccc2)Br 34a_100010187735_200025704644 [0,2,0,0,0,0|2,0,0]=4 1900 B14R2.11635 [13CH3]Sc1cccc2c1c(=O)[nH]cn2 62a_200025704644_100000696754 [0,2,0,0,0,0|2,0,0]=4 1901 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)Br 62a_100010243825_200025704644 [0,2,0,0,0,0|2,0,0]=4 1902 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)Br 62a_200025704644_100010243825 [0,2,0,0,0,0|2,0,0]=4 1903 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)F 62a_100010177852_200025704644 [0,2,0,0,0,0|2,0,0]=4 1904 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)F 62a_200025704644_100010177852 [0,2,0,0,0,0|2,0,0]=4 1905 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)N 62a_100010002837_200025704644 [0,2,0,0,0,0|2,0,0]=4 1906 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)O 62a_200025704644_100010089961 [0,2,0,0,0,0|2,0,0]=4 1907 B14R2.11635 [13CH3]Sc1cccc2c1c(ncn2)N 62a_100010171649_200025704644 [0,2,0,0,0,0|2,0,0]=4 1908 B14R2.31359 C=C(C)c1cccc2c1cccc2 271570a_100000694244_100000210605 [0,2,0,0,0,0|2,0,0]=4 1909 B14R2.31359 C=C(C)c1cccc2c1cccn2 271570a_100000694244_100011290932 [0,2,0,0,0,0|1,0,0]=3 1910 B14R2.31359 C=C(C)c1cccc2c1cncn2 271570a_100000694244_100009814520 [0,2,0,0,0,0|2,0,0]=4 1911 B14R2.31359 C=C(C)c1cccc2c1nccc2 271570a_100000694244_100011215545 [0,2,0,0,0,0|1,0,0]=3 1912 B14R2.31359 C=C(C)c1cccc2c1nccn2 271570a_100000694244_100010003881 [0,2,0,0,0,0|0,0,0]=2 1913 B14R2.31359 C=C(C)c1cccc2c1ncnc2 271570a_100000694244_100010246313 [0,2,0,0,0,0|2,0,0]=4 1914 B14R2.31359 C=C(C)c1ccnc2c1cccn2 271570a_100000694244_100000087570 [0,2,0,0,0,0|2,0,0]=4 1915 B14R2.31359 C=C(C)c1ccnc2c1nccn2 271570a_100000694244_100010783457 [0,2,0,0,0,0|1,0,0]=3 1916 B14R2.31359 C=C(C)c1cncc2c1cccn2 271570a_100000694244_100010211308 [0,2,0,0,0,0|2,0,0]=4 1917 B14R2.31359 C=C(C)c1cncc2c1nccn2 271570a_100000694244_200010209543 [0,2,0,0,0,0|1,0,0]=3 1918 B14R2.31359 C=C(C)c1nccc2c1cccn2 271570a_100000694244_100000077681 [0,2,0,0,0,0|2,0,0]=4 1919 B14R2.31359 C=C(C)c1nccc2c1nccc2 271570a_100000694244_100010063729 [0,2,0,0,0,0|2,0,0]=4 1920 B14R2.31359 C=C(C)c1nccc2c1nccn2 271570a_100000694244_100010063732 [0,2,0,0,0,0|1,0,0]=3 1921 B14R2.31359 CC(=O)c1cccc2c1cccc2 1458a_100000210949_200000210301 [0,2,0,0,0,0|2,0,0]=4 1922 B14R2.31359 CC(=O)c1cccc2c1cccn2 1458a_100000241005_200000210301 [0,2,0,0,0,0|1,0,0]=3 1923 B14R2.31359 CC(=O)c1cccc2c1nccc2 1458a_100000195423_200000210301 [0,2,0,0,0,0|1,0,0]=3 1924 B14R2.31359 CC(=O)c1cccc2c1nccn2 1458a_100000048969_200000210301 [0,2,0,0,0,0|0,0,0]=2 1925 B14R2.31359 CN(C)c1cccc2c1cccc2 2230a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 1926 B14R2.31359 CN(C)c1cccc2c1cccc2 269982a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 1927 B14R2.31359 CN(C)c1cccc2c1cccc2 34a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 1928 B14R2.31359 CN(C)c1cccc2c1cccn2 27a_100102631434_100011290932 [0,2,0,0,0,0|1,0,0]=3 1929 B14R2.31359 CN(C)c1cccc2c1cncn2 27a_100102631434_100009814520 [0,2,0,0,0,0|2,0,0]=4 1930 B14R2.31359 CN(C)c1cccc2c1nccn2 27a_100102631434_100010003881 [0,2,0,0,0,0|0,0,0]=2 1931 B14R2.31359 CN(C)c1cccc2c1ncnc2 27a_100102631434_100010246313 [0,2,0,0,0,0|2,0,0]=4 1932 B14R2.31359 CN(C)c1ccnc2c1cccn2 27a_100102631434_100000087570 [0,2,0,0,0,0|2,0,0]=4 1933 B14R2.31359 CN(C)c1ccnc2c1nccn2 27a_100102631434_100010783457 [0,2,0,0,0,0|1,0,0]=3 1934 B14R2.31359 CN(C)c1cncc2c1cccn2 27a_100102631434_100010211308 [0,2,0,0,0,0|2,0,0]=4 1935 B14R2.31359 CN(C)c1cncc2c1nccn2 27a_100102631434_200010209543 [0,2,0,0,0,0|1,0,0]=3 1936 B14R2.31359 CN(C)c1nccc2c1cccn2 27a_100102631434_100000077681 [0,2,0,0,0,0|2,0,0]=4 1937 B14R2.31359 CN(C)c1nccc2c1nccc2 27a_100102631434_100010063729 [0,2,0,0,0,0|2,0,0]=4 1938 B14R2.31359 CN(C)c1nccc2c1nccn2 27a_100102631434_100010063732 [0,2,0,0,0,0|1,0,0]=3 1939 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 2230a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 1940 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 269982a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 1941 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 34a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 1942 B14R2.31359 [13CH3]C(=O)c1cccc2c1cccc2 1458a_100000210949_200025704644 [0,2,0,0,0,0|2,0,0]=4 1943 B14R2.31359 [13CH3]C(=O)c1cccc2c1cccn2 1458a_100000241005_200025704644 [0,2,0,0,0,0|1,0,0]=3 1944 B14R2.31359 [13CH3]C(=O)c1cccc2c1nccc2 1458a_100000195423_200025704644 [0,2,0,0,0,0|1,0,0]=3 1945 B14R2.31359 [13CH3]C(=O)c1cccc2c1nccn2 1458a_100000048969_200025704644 [0,2,0,0,0,0|0,0,0]=2 1946 B14R2.1801 C=Cc1cnc2c(cccc2c1)Br 271570a_100011290941_100010204298 [0,2,0,0,0,0|2,0,0]=4 1947 B14R2.1801 C=Cc1cnc2c(cccc2c1)C 271570a_100011290941_100009829671 [0,2,0,0,0,0|1,0,0]=3 1948 B14R2.1801 C=Cc1cnc2c(cccc2c1)Cl 271570a_100011290941_100000759377 [0,2,0,0,0,0|2,0,0]=4 1949 B14R2.1801 C=Cc1cnc2c(cccc2c1)F 271570a_100011290941_100000049890 [0,2,0,0,0,0|2,0,0]=4 1950 B14R2.1801 C=Cc1cnc2c(cccc2c1)N 271570a_100011290941_100000702407 [0,2,0,0,0,0|2,0,0]=4 1951 B14R2.1801 COc1cnc2c(cccc2c1)F 34a_100012184956_200000210301 [0,2,0,0,0,0|2,0,0]=4 1952 B14R2.1801 COc1cnc2c(cccc2c1)F 7a_100012184956_200000210301 [0,2,0,0,0,0|2,0,0]=4 1953 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_100010204298_200000210301 [0,2,0,0,0,0|2,0,0]=4 1954 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_200000210301_100010204298 [0,2,0,0,0,0|2,0,0]=4 1955 B14R2.1801 CSc1cnc2c(cccc2c1)C 62a_200000210301_100009829671 [0,2,0,0,0,0|1,0,0]=3 1956 B14R2.1801 CSc1cnc2c(cccc2c1)Cl 62a_200000210301_100000759377 [0,2,0,0,0,0|2,0,0]=4 1957 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_100000049890_200000210301 [0,2,0,0,0,0|2,0,0]=4 1958 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_200000210301_100000049890 [0,2,0,0,0,0|2,0,0]=4 1959 B14R2.1801 CSc1cnc2c(cccc2c1)N 62a_200000210301_100000702407 [0,2,0,0,0,0|2,0,0]=4 1960 B14R2.1801 Cc1cccc2c1ncc(c2)S[13CH3] 62a_200025704644_100009829671 [0,2,0,0,0,0|1,0,0]=3 1961 B14R2.1801 N#Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010235449 [0,2,0,0,0,0|2,0,0]=4 1962 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 34a_100012184956_200025704644 [0,2,0,0,0,0|2,0,0]=4 1963 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 7a_100012184956_200025704644 [0,2,0,0,0,0|2,0,0]=4 1964 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_100010204298_200025704644 [0,2,0,0,0,0|2,0,0]=4 1965 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_200025704644_100010204298 [0,2,0,0,0,0|2,0,0]=4 1966 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Cl 62a_200025704644_100000759377 [0,2,0,0,0,0|2,0,0]=4 1967 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_100000049890_200025704644 [0,2,0,0,0,0|2,0,0]=4 1968 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_200025704644_100000049890 [0,2,0,0,0,0|2,0,0]=4 1969 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)N 62a_200025704644_100000702407 [0,2,0,0,0,0|2,0,0]=4 1970 B12R2.2 C1=C(CCC1)c2cnccn2 271570a_100000089523_100000758340 [0,0,1,1,0,0|0,0,2]=4 1971 B12R2.2 C1=C(CCO1)c2cnccn2 271570a_100000118173_100000758340 [0,0,1,1,0,0|1,0,1]=4 1972 B12R2.2 C1=C(COC1)c2cnccn2 271570a_100009872500_100000758340 [0,0,1,1,0,0|1,0,1]=4 1973 B12R2.2 C1=CCN(C1)c2cnccn2 27a_100015195280_100000211759 [0,0,1,1,0,0|1,0,1]=4 1974 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100000750936_100011216584 [0,0,1,1,0,0|2,0,0]=4 1975 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100011264011_100009814098 [0,0,1,1,0,0|2,0,0]=4 1976 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100000742291_100011216584 [0,0,1,1,0,0|2,0,0]=4 1977 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100011264011_100011215356 [0,0,1,1,0,0|2,0,0]=4 1978 B12R2.2 c1cnc(cn1)c2c[nH]cn2 271570a_100011962566_100000756875 [0,0,1,1,0,0|2,0,0]=4 1979 B12R2.2 c1cnc(cn1)c2cc[nH]c2 271570a_100000102155_100000758340 [0,0,1,1,0,0|1,0,1]=4 1980 B12R2.2 c1cnc(cn1)c2cc[nH]n2 271570a_100000062414_100000758340 [0,0,1,1,0,0|2,0,0]=4 1981 B12R2.2 c1cnc(cn1)c2cc[nH]n2 271570a_100011962566_100000062575 [0,0,1,1,0,0|2,0,0]=4 1982 B12R2.2 c1cnc(cn1)c2ccoc2 271570a_100011218838_100000758340 [0,0,1,1,0,0|1,0,1]=4 1983 B12R2.2 c1cnc(cn1)c2ccoc2 271570a_100011962566_100011215275 [0,0,1,1,0,0|1,0,1]=4 1984 B12R2.2 c1cnc(cn1)c2ccsc2 271570a_100011934443_100000758340 [0,0,1,1,0,0|1,0,1]=4 1985 B12R2.2 c1cnc(cn1)c2ccsc2 271570a_100011962566_100000738268 [0,0,1,1,0,0|1,0,1]=4 1986 B12R2.2 c1cnc(cn1)c2ccsn2 271570a_100011962566_100009818082 [0,0,1,1,0,0|2,0,0]=4 1987 B12R2.2 c1cnc(cn1)c2cnco2 271570a_100011962566_100020591547 [0,0,1,1,0,0|2,0,0]=4 1988 B12R2.2 c1cnc(cn1)c2cncs2 271570a_100010231675_100000758340 [0,0,1,1,0,0|2,0,0]=4 1989 B12R2.2 c1cnc(cn1)c2cncs2 271570a_100011962566_100011934649 [0,0,1,1,0,0|2,0,0]=4 1990 B12R2.2 c1cnc(cn1)c2cscn2 271570a_100011962566_100000751502 [0,0,1,1,0,0|2,0,0]=4 1991 B12R2.2 c1cnc(cn1)c2ncc[nH]2 271570a_100011962566_100025796157 [0,0,1,1,0,0|2,0,0]=4 1992 B12R2.2 c1cnc(cn1)c2ncc[nH]2 271570a_100016988920_100000758340 [0,0,1,1,0,0|2,0,0]=4 1993 B12R2.2 c1cnc(cn1)c2ncco2 271570a_100011962566_100011787736 [0,0,1,1,0,0|2,0,0]=4 1994 B12R2.2 c1cnc(cn1)c2nccs2 271570a_100011962566_100000211983 [0,0,1,1,0,0|2,0,0]=4 1995 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000750936_100000752921 [0,0,1,1,0,0|2,0,0]=4 1996 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000757648_100009814098 [0,0,1,1,0,0|2,0,0]=4 1997 B12R2.2 c1cncc(c1)c2cccs2 271570a_100000742291_100000752921 [0,0,1,1,0,0|2,0,0]=4 1998 B12R2.2 c1cncc(c1)c2cccs2 271570a_100000757648_100011215356 [0,0,1,1,0,0|2,0,0]=4 1999 B12R2.2 c1coc(c1)c2cnccn2 271570a_100000750936_100000758340 [0,0,1,1,0,0|1,0,0]=3 2000 B12R2.2 c1coc(c1)c2cnccn2 271570a_100011962566_100009814098 [0,0,1,1,0,0|1,0,0]=3 2001 B12R2.2 c1csc(c1)c2cnccn2 271570a_100000742291_100000758340 [0,0,1,1,0,0|1,0,0]=3 2002 B12R2.2 c1csc(c1)c2cnccn2 271570a_100011962566_100011215356 [0,0,1,1,0,0|1,0,0]=3 2003 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,0,1,1,0,0|2,0,0]=4 2004 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,0,1,1,0,0|2,0,0]=4 2005 B12R2.2057 C(=CC1CC1)c2cnccn2 271570a_100102526188_100000758340 [0,0,1,1,0,0|0,0,2]=4 2006 B10R1.39 C=C(C)c1ccoc1C=O 271570a_100000694244_100000756499 [0,0,1,0,1,0|2,0,0]=4 2007 B10R1.39 C=C(C)c1ccsc1C=O 271570a_100000694244_100000766043 [0,0,1,0,1,0|2,0,0]=4 2008 B10R1.39 C=C(C)c1sccc1C=O 271570a_100000694244_100009816921 [0,0,1,0,1,0|2,0,0]=4 2009 B10R1.39 C=Cc1ccsc1C(=O)C 271570a_100011290941_100000738688 [0,0,1,0,1,0|2,0,0]=4 2010 B10R1.39 C=Cc1ncsc1C(=O)C 271570a_100011290941_200010339033 [0,0,1,0,1,0|2,0,0]=4