0 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,0,0,0,0,0|1,0,0]=1 1 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,0,0,0,0,0|2,0,0]=2 2 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,0,0,0,0,0|1,0,0]=1 5 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,0,0,0,0,0|2,0,0]=2 6 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,0,0,0,0,0|2,0,0]=2 7 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,0,0,0,0,0|1,0,0]=1 8 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [0,0,0,0,0,0|2,0,0]=2 9 B13R2.32 Nc1c(ccc2c1ccnc2)O 271570a_203496583355_100010191621 [0,0,0,0,0,0|2,0,0]=2 10 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,0,0,0,0,0|2,0,0]=2 12 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [0,0,0,0,0,0|2,0,0]=2 14 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,0,0,0,0,0|2,0,0]=2 15 B13R2.32 Nc1ccc2nccnc2c1O 271570a_203496583355_100000729981 [0,0,0,0,0,0|3,0,0]=3 16 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [0,0,0,0,0,0|2,0,0]=2 17 B13R2.32 Nc1cnc2cccnc2c1O 271570a_203496583355_100009889961 [0,0,0,0,0,0|3,0,0]=3 18 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,0,0,0,0,0|2,0,0]=2 19 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,0,0,0,0,0|1,0,1]=2 20 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,0,0,0,0,0|1,0,1]=2 21 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,0,0,0,0,0|1,0,0]=1 22 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [0,0,0,0,0,0|2,0,0]=2 23 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [0,0,0,0,0,0|2,0,0]=2 24 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [0,0,0,0,0,0|2,0,0]=2 25 B13R2.32 Oc1ccc2c(c1O)CCCC2 271570a_203496583355_200010391107 [0,0,0,0,0,0|0,0,4]=4 26 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,0,0,0,0,0|1,0,0]=1 27 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,0,0,0,0,0|1,0,0]=1 28 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,0,0,0,0,0|0,0,0]=0 29 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,0,0,0,0,0|0,0,0]=0 30 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [0,0,0,0,0,0|2,0,0]=2 31 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,0,0,0,0,0|1,0,0]=1 32 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,0,0,0,0,0|1,0,0]=1 33 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [0,0,0,0,0,0|1,0,0]=1 34 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,0,0,0,0,0|2,0,0]=2 35 B13R2.32 Oc1nnc2ccccc2c1O 271570a_203496583355_100000688347 [0,0,0,0,0,0|2,0,0]=2 36 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [1,0,0,0,0,0|1,0,0]=2 37 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [1,0,0,0,0,0|3,0,0]=4 38 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [1,0,0,0,0,0|0,0,0]=1 39 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [1,0,0,0,0,0|1,0,0]=2 40 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [1,0,0,0,0,0|1,0,0]=2 41 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [1,0,0,0,0,0|2,0,0]=3 42 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [1,0,0,0,0,0|1,0,0]=2 43 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [1,0,0,0,0,0|2,0,0]=3 44 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [1,0,0,0,0,0|1,0,0]=2 45 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [1,0,0,0,0,0|2,0,0]=3 46 B12R2.24 Oc1ccc2cnncc2c1 271570a_203496583355_100010198781 [1,0,0,0,0,0|2,0,0]=3 47 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [1,0,0,0,0,0|1,0,0]=2 48 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [1,0,0,0,0,0|2,0,0]=3 49 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [1,0,0,0,0,0|2,0,0]=3 50 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [1,0,0,0,0,0|3,0,0]=4 51 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [1,0,0,0,0,0|2,0,0]=3 52 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [1,0,0,0,0,0|2,0,0]=3 53 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [1,0,0,0,0,0|1,0,0]=2 54 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [1,0,0,0,0,0|2,0,0]=3 55 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [1,0,0,0,0,0|2,0,0]=3 56 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [1,0,0,0,0,0|3,0,0]=4 57 B12R2.24 Oc1cnc2nccnc2c1 271570a_203496583355_100000753224 [1,0,0,0,0,0|3,0,0]=4 58 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [1,0,0,0,0,0|2,0,0]=3 59 B12R2.1081 Oc1cccc2c1CCN=C2 271570a_203496583355_100010982778 [1,0,0,0,0,0|1,0,2]=4 60 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [1,0,0,0,0,0|0,0,0]=1 61 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [1,0,0,0,0,0|1,0,0]=2 62 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [1,0,0,0,0,0|1,0,0]=2 63 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [1,0,0,0,0,0|1,0,0]=2 64 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [1,0,0,0,0,0|2,0,0]=3 65 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [1,0,0,0,0,0|1,0,0]=2 66 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [1,0,0,0,0,0|2,0,0]=3 67 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [1,0,0,0,0,0|2,0,0]=3 68 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [1,0,0,0,0,0|1,0,0]=2 69 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [1,0,0,0,0,0|2,0,0]=3 70 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [1,0,0,0,0,0|2,0,0]=3 71 B12R2.1081 Oc1ccnc2c1nccn2 271570a_203496583355_100010783457 [1,0,0,0,0,0|3,0,0]=4 72 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [1,0,0,0,0,0|1,0,0]=2 73 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [1,0,0,0,0,0|2,0,0]=3 74 B12R2.1081 Oc1cncc2c1ccnc2 271570a_203496583355_100010134378 [1,0,0,0,0,0|2,0,0]=3 75 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [1,0,0,0,0,0|3,0,0]=4 76 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [1,0,0,0,0,0|2,0,0]=3 77 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [1,0,0,0,0,0|1,0,0]=2 78 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [1,0,0,0,0,0|2,0,0]=3 79 B12R2.1081 Oc1nccc2c1cncc2 271570a_203496583355_100000116921 [1,0,0,0,0,0|2,0,0]=3 80 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [1,0,0,0,0,0|2,0,0]=3 81 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [1,0,0,0,0,0|3,0,0]=4 82 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [1,0,0,0,0,0|2,0,0]=3 83 B12R2.1081 Oc1ncnc2c1cccn2 271570a_203496583355_100000026734 [1,0,0,0,0,0|3,0,0]=4 84 B12R2.1081 Oc1ncnc2c1ccnc2 271570a_203496583355_100000098430 [1,0,0,0,0,0|3,0,0]=4 85 B14R2.92 C=Cc1c[nH]c2ccccc2c1=O 271570a_100011290941_100012339567 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [0,1,0,0,0,0|2,0,0]=3 87 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [0,1,0,0,0,0|2,0,0]=3 88 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [0,1,0,0,0,0|2,0,0]=3 89 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [0,1,0,0,0,0|2,0,0]=3 90 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [0,1,0,0,0,0|1,0,0]=2 91 B14R2.92 C=Cc1ccc2cccnc2c1C 271570a_100011290941_100010214467 [0,1,0,0,0,0|3,0,0]=4 92 B14R2.92 C=Cc1ccc2cccnc2c1F 271570a_100011290941_100010751467 [0,1,0,0,0,0|3,0,0]=4 93 B14R2.92 C=Cc1ccc2cccnc2c1O 271570a_100011290941_100009816563 [0,1,0,0,0,0|2,0,0]=3 94 B14R2.92 C=Cc1ccc2cnccc2c1N 271570a_100011290941_100010191621 [0,1,0,0,0,0|3,0,0]=4 95 B14R2.92 C=Cc1ccc2ncccc2c1C 271570a_100011290941_200010137439 [0,1,0,0,0,0|3,0,0]=4 96 B14R2.92 C=Cc1ccc2ncccc2c1N 271570a_100011290941_200010235790 [0,1,0,0,0,0|3,0,0]=4 97 B14R2.92 C=Cc1cnc2ccccc2c1Cl 271570a_100011290941_100012352519 [0,1,0,0,0,0|3,0,0]=4 98 B14R2.92 C=Cc1cnc2ccccc2c1N 271570a_100011290941_100009995562 [0,1,0,0,0,0|3,0,0]=4 99 B14R2.92 C=Cc1coc2ccccc2c1=O 271570a_100011290941_100009813851 [0,1,0,0,0,0|2,0,1]=4 100 B14R2.92 C=Cc1ncc2ccccc2c1N 271570a_100011290941_100000087573 [0,1,0,0,0,0|3,0,0]=4 101 B14R2.92 C=Cc1nnc2ccccc2c1O 271570a_100011290941_100000688347 [0,1,0,0,0,0|3,0,0]=4 102 B14R2.92 CNc1ccc2ccccc2c1Br 34a_100000705303_200000210301 [0,1,0,0,0,0|2,0,0]=3 103 B14R2.92 CNc1ccc2ccccc2c1Cl 34a_100000075557_200000210301 [0,1,0,0,0,0|2,0,0]=3 104 B14R2.92 CNc1ccc2ccccc2c1O 34a_100000007060_200000210301 [0,1,0,0,0,0|1,0,0]=2 105 B14R2.92 CNc1ccc2cnccc2c1Cl 34a_100009851981_200000210301 [0,1,0,0,0,0|3,0,0]=4 106 B14R2.92 CNc1ccc2ncccc2c1Br 34a_200009995563_200000210301 [0,1,0,0,0,0|3,0,0]=4 107 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [0,1,0,0,0,0|1,0,0]=2 108 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [0,1,0,0,0,0|1,0,0]=2 109 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,1,0,0,0,0|1,0,0]=2 110 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [0,1,0,0,0,0|1,0,0]=2 112 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [0,1,0,0,0,0|1,0,0]=2 113 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [0,1,0,0,0,0|1,0,0]=2 114 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [0,1,0,0,0,0|1,0,0]=2 116 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [0,1,0,0,0,0|1,0,0]=2 117 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [0,1,0,0,0,0|0,0,0]=1 118 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [0,1,0,0,0,0|2,0,0]=3 119 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [0,1,0,0,0,0|2,0,0]=3 120 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [0,1,0,0,0,0|1,0,0]=2 121 B14R2.92 COc1ccc2ccncc2c1Br 34a_200010115057_200000210301 [0,1,0,0,0,0|2,0,0]=3 122 B14R2.92 COc1ccc2ccncc2c1Br 7a_200010115057_200000210301 [0,1,0,0,0,0|2,0,0]=3 123 B14R2.92 COc1ccc2cnccc2c1Cl 34a_100009824633_200000210301 [0,1,0,0,0,0|2,0,0]=3 124 B14R2.92 COc1ccc2cnccc2c1Cl 7a_100009824633_200000210301 [0,1,0,0,0,0|2,0,0]=3 125 B14R2.92 CSc1c[nH]c2ccccc2c1=O 62a_200000210301_100012348052 [0,1,0,0,0,0|1,1,1]=4 126 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200000210301_200010089984 [0,1,0,0,0,0|1,1,0]=3 127 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200010089984_200000210301 [0,1,0,0,0,0|1,1,0]=3 128 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [0,1,0,0,0,0|1,1,0]=3 129 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [0,1,0,0,0,0|1,1,0]=3 130 B14R2.92 CSc1ccc2ccccc2c1F 62a_100009832041_200000210301 [0,1,0,0,0,0|1,1,0]=3 131 B14R2.92 CSc1ccc2ccccc2c1F 62a_200000210301_100009832041 [0,1,0,0,0,0|1,1,0]=3 132 B14R2.92 CSc1ccc2ccccc2c1N 62a_100009817101_200000210301 [0,1,0,0,0,0|1,1,0]=3 133 B14R2.92 CSc1ccc2ccccc2c1O 62a_200000210301_100009996032 [0,1,0,0,0,0|0,1,0]=2 134 B14R2.92 CSc1ccc2cccnc2c1C 62a_200000210301_100010214467 [0,1,0,0,0,0|2,1,0]=4 135 B14R2.92 CSc1ccc2cccnc2c1F 62a_100010751467_200000210301 [0,1,0,0,0,0|2,1,0]=4 136 B14R2.92 CSc1ccc2cccnc2c1F 62a_200000210301_100010751467 [0,1,0,0,0,0|2,1,0]=4 137 B14R2.92 CSc1ccc2cccnc2c1O 62a_200000210301_100009816563 [0,1,0,0,0,0|1,1,0]=3 138 B14R2.92 CSc1ccc2cnccc2c1N 62a_100010191621_200000210301 [0,1,0,0,0,0|2,1,0]=4 139 B14R2.92 CSc1ccc2cnccc2c1N 62a_200000210301_100010191621 [0,1,0,0,0,0|2,1,0]=4 140 B14R2.92 CSc1ccc2ncccc2c1C 62a_200000210301_200010137439 [0,1,0,0,0,0|2,1,0]=4 141 B14R2.92 CSc1ccc2ncccc2c1C 62a_200010137439_200000210301 [0,1,0,0,0,0|2,1,0]=4 142 B14R2.92 CSc1ccc2ncccc2c1N 62a_200010235790_200000210301 [0,1,0,0,0,0|2,1,0]=4 143 B14R2.92 CSc1cnc2ccccc2c1Cl 62a_200000210301_100012352519 [0,1,0,0,0,0|2,1,0]=4 144 B14R2.92 CSc1cnc2ccccc2c1N 62a_100009995562_200000210301 [0,1,0,0,0,0|2,1,0]=4 145 B14R2.92 CSc1cnc2ccccc2c1N 62a_200000210301_100009995562 [0,1,0,0,0,0|2,1,0]=4 146 B14R2.92 CSc1coc2ccccc2c1=O 62a_200000210301_100009813851 [0,1,0,0,0,0|1,1,1]=4 147 B14R2.92 CSc1ncc2ccccc2c1N 62a_100009995564_200000210301 [0,1,0,0,0,0|2,1,0]=4 148 B14R2.92 CSc1ncc2ccccc2c1N 62a_200000210301_100000087573 [0,1,0,0,0,0|2,1,0]=4 149 B14R2.92 CSc1nnc2ccccc2c1O 62a_200000210301_100000688347 [0,1,0,0,0,0|2,1,0]=4 150 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,1,0,0,0,0|1,0,0]=2 151 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,1,0,0,0,0|1,0,0]=2 152 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [0,1,0,0,0,0|1,1,0]=3 153 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [0,1,0,0,0,0|1,1,0]=3 154 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200010137439_200025704644 [0,1,0,0,0,0|2,1,0]=4 155 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200025704644_200010137439 [0,1,0,0,0,0|2,1,0]=4 156 B14R2.92 Cc1c(ccc2c1nccc2)S[13CH3] 62a_200025704644_100010214467 [0,1,0,0,0,0|2,1,0]=4 157 B14R2.92 N#Cc1cnc2ccccc2c1O 271570a_203496583355_100000741524 [0,1,0,0,0,0|2,0,0]=3 158 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [0,1,0,0,0,0|0,0,1]=2 159 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Br 34a_100000705303_200025704644 [0,1,0,0,0,0|2,0,0]=3 160 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Cl 34a_100000075557_200025704644 [0,1,0,0,0,0|2,0,0]=3 161 B14R2.92 [13CH3]Nc1ccc2ccccc2c1O 34a_100000007060_200025704644 [0,1,0,0,0,0|1,0,0]=2 162 B14R2.92 [13CH3]Nc1ccc2cnccc2c1Cl 34a_100009851981_200025704644 [0,1,0,0,0,0|3,0,0]=4 163 B14R2.92 [13CH3]Nc1ccc2ncccc2c1Br 34a_200009995563_200025704644 [0,1,0,0,0,0|3,0,0]=4 164 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [0,1,0,0,0,0|1,0,0]=2 165 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [0,1,0,0,0,0|1,0,0]=2 166 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [0,1,0,0,0,0|1,0,0]=2 167 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [0,1,0,0,0,0|1,0,0]=2 168 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [0,1,0,0,0,0|1,0,0]=2 169 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [0,1,0,0,0,0|1,0,0]=2 170 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [0,1,0,0,0,0|1,0,0]=2 171 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [0,1,0,0,0,0|1,0,0]=2 172 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [0,1,0,0,0,0|2,0,0]=3 173 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [0,1,0,0,0,0|2,0,0]=3 174 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 34a_200010115057_200025704644 [0,1,0,0,0,0|2,0,0]=3 175 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 7a_200010115057_200025704644 [0,1,0,0,0,0|2,0,0]=3 176 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 34a_100009824633_200025704644 [0,1,0,0,0,0|2,0,0]=3 177 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 7a_100009824633_200025704644 [0,1,0,0,0,0|2,0,0]=3 178 B14R2.92 [13CH3]Sc1c[nH]c2ccccc2c1=O 62a_200025704644_100012348052 [0,1,0,0,0,0|1,1,1]=4 179 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200010089984_200025704644 [0,1,0,0,0,0|1,1,0]=3 180 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200025704644_200010089984 [0,1,0,0,0,0|1,1,0]=3 181 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_100009832041_200025704644 [0,1,0,0,0,0|1,1,0]=3 182 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_200025704644_100009832041 [0,1,0,0,0,0|1,1,0]=3 183 B14R2.92 [13CH3]Sc1ccc2ccccc2c1N 62a_100009817101_200025704644 [0,1,0,0,0,0|1,1,0]=3 184 B14R2.92 [13CH3]Sc1ccc2ccccc2c1O 62a_200025704644_100009996032 [0,1,0,0,0,0|0,1,0]=2 185 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_100010751467_200025704644 [0,1,0,0,0,0|2,1,0]=4 186 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_200025704644_100010751467 [0,1,0,0,0,0|2,1,0]=4 187 B14R2.92 [13CH3]Sc1ccc2cccnc2c1O 62a_200025704644_100009816563 [0,1,0,0,0,0|1,1,0]=3 188 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_100010191621_200025704644 [0,1,0,0,0,0|2,1,0]=4 189 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_200025704644_100010191621 [0,1,0,0,0,0|2,1,0]=4 190 B14R2.92 [13CH3]Sc1ccc2ncccc2c1N 62a_200010235790_200025704644 [0,1,0,0,0,0|2,1,0]=4 191 B14R2.92 [13CH3]Sc1cnc2ccccc2c1Cl 62a_200025704644_100012352519 [0,1,0,0,0,0|2,1,0]=4 192 B14R2.92 [13CH3]Sc1cnc2ccccc2c1N 62a_100009995562_200025704644 [0,1,0,0,0,0|2,1,0]=4 193 B14R2.92 [13CH3]Sc1cnc2ccccc2c1N 62a_200025704644_100009995562 [0,1,0,0,0,0|2,1,0]=4 194 B14R2.92 [13CH3]Sc1coc2ccccc2c1=O 62a_200025704644_100009813851 [0,1,0,0,0,0|1,1,1]=4 195 B14R2.92 [13CH3]Sc1ncc2ccccc2c1N 62a_100009995564_200025704644 [0,1,0,0,0,0|2,1,0]=4 196 B14R2.92 [13CH3]Sc1ncc2ccccc2c1N 62a_200025704644_100000087573 [0,1,0,0,0,0|2,1,0]=4 197 B14R2.92 [13CH3]Sc1nnc2ccccc2c1O 62a_200025704644_100000688347 [0,1,0,0,0,0|2,1,0]=4 198 B14R2.203 C=Cc1c(ccc2c1cccc2)Br 271570a_100011290941_100010090040 [0,1,0,0,0,0|2,0,0]=3 199 B14R2.203 C=Cc1c(ccc2c1cccc2)C 271570a_100011290941_100000759710 [0,1,0,0,0,0|2,0,0]=3 200 B14R2.203 C=Cc1c(ccc2c1cccc2)N 271570a_100011290941_100000705303 [0,1,0,0,0,0|2,0,0]=3 201 B14R2.203 C=Cc1c(ccc2c1cccc2)O 271570a_100011290941_100000183829 [0,1,0,0,0,0|1,0,0]=2 202 B14R2.203 C=Cc1c(ccc2c1cccn2)N 271570a_100011290941_200009995563 [0,1,0,0,0,0|3,0,0]=4 203 B14R2.203 C=Cc1c(ccc2c1ccnc2)C 271570a_100011290941_100010204589 [0,1,0,0,0,0|3,0,0]=4 204 B14R2.203 C=Cc1c(ccc2c1ccnc2)F 271570a_100011290941_100010272212 [0,1,0,0,0,0|3,0,0]=4 205 B14R2.203 C=Cc1c(ccc2c1ccnc2)N 271570a_100011290941_100010245214 [0,1,0,0,0,0|3,0,0]=4 206 B14R2.203 C=Cc1c(ccc2c1cncc2)F 271570a_100011290941_200015767032 [0,1,0,0,0,0|3,0,0]=4 207 B14R2.203 C=Cc1c(ccc2c1cncc2)O 271570a_100011290941_200010115057 [0,1,0,0,0,0|2,0,0]=3 208 B14R2.203 C=Cc1c(ccc2c1nccc2)O 271570a_100011290941_100010173343 [0,1,0,0,0,0|2,0,0]=3 209 B14R2.203 C=Cc1c(cnc2c1cccc2)Br 271570a_100011290941_200010179490 [0,1,0,0,0,0|3,0,0]=4 210 B14R2.203 C=Cc1c(cnc2c1cccc2)C 271570a_100011290941_100000092342 [0,1,0,0,0,0|3,0,0]=4 211 B14R2.203 C=Cc1c(cnc2c1cccc2)N 271570a_100011290941_100012243074 [0,1,0,0,0,0|3,0,0]=4 212 B14R2.203 C=Cc1c(ncc2c1cccc2)N 271570a_100011290941_100009994184 [0,1,0,0,0,0|3,0,0]=4 213 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [0,1,0,0,0,0|2,0,0]=3 214 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [0,1,0,0,0,0|2,0,0]=3 215 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [0,1,0,0,0,0|2,0,0]=3 216 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [0,1,0,0,0,0|1,0,0]=2 217 B14R2.203 CNc1c(ccc2c1cccn2)C 34a_100011933972_200000210301 [0,1,0,0,0,0|3,0,0]=4 218 B14R2.203 CNc1c(ccc2c1nccc2)C 34a_100000065890_200000210301 [0,1,0,0,0,0|3,0,0]=4 219 B14R2.203 CNc1c(cnc2c1cccc2)C 27a_100102657272_100000092342 [0,1,0,0,0,0|3,0,0]=4 220 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [0,1,0,0,0,0|1,0,0]=2 221 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [0,1,0,0,0,0|1,0,0]=2 222 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [0,1,0,0,0,0|1,0,0]=2 223 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [0,1,0,0,0,0|1,0,0]=2 224 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [0,1,0,0,0,0|1,0,0]=2 225 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [0,1,0,0,0,0|0,0,0]=1 226 B14R2.203 COc1c(ccc2c1nccc2)Br 34a_100009816563_200000210301 [0,1,0,0,0,0|2,0,0]=3 227 B14R2.203 COc1c(ccc2c1nccc2)Cl 34a_100000700379_200000210301 [0,1,0,0,0,0|2,0,0]=3 228 B14R2.203 COc1c(ccc2c1nccc2)Cl 7a_100000700379_200000210301 [0,1,0,0,0,0|2,0,0]=3 229 B14R2.203 COc1c(ccc2c1nccc2)O 271570a_203496583355_100010256708 [0,1,0,0,0,0|1,0,0]=2 230 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [0,1,0,0,0,0|1,1,0]=3 231 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [0,1,0,0,0,0|1,1,0]=3 232 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [0,1,0,0,0,0|1,1,0]=3 233 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [0,1,0,0,0,0|1,1,0]=3 234 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [0,1,0,0,0,0|1,1,0]=3 235 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [0,1,0,0,0,0|1,1,0]=3 236 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [0,1,0,0,0,0|0,1,0]=2 237 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200000210301_200009995563 [0,1,0,0,0,0|2,1,0]=4 238 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200009995563_200000210301 [0,1,0,0,0,0|2,1,0]=4 239 B14R2.203 CSc1c(ccc2c1ccnc2)C 62a_100010204589_200000210301 [0,1,0,0,0,0|2,1,0]=4 240 B14R2.203 CSc1c(ccc2c1ccnc2)C 62a_200000210301_100010204589 [0,1,0,0,0,0|2,1,0]=4 241 B14R2.203 CSc1c(ccc2c1ccnc2)F 62a_100010272212_200000210301 [0,1,0,0,0,0|2,1,0]=4 242 B14R2.203 CSc1c(ccc2c1ccnc2)F 62a_200000210301_100010272212 [0,1,0,0,0,0|2,1,0]=4 243 B14R2.203 CSc1c(ccc2c1ccnc2)N 62a_100010245214_200000210301 [0,1,0,0,0,0|2,1,0]=4 244 B14R2.203 CSc1c(ccc2c1ccnc2)N 62a_200000210301_100010245214 [0,1,0,0,0,0|2,1,0]=4 245 B14R2.203 CSc1c(ccc2c1cncc2)F 62a_200000210301_200015767032 [0,1,0,0,0,0|2,1,0]=4 246 B14R2.203 CSc1c(ccc2c1cncc2)F 62a_200015767032_200000210301 [0,1,0,0,0,0|2,1,0]=4 247 B14R2.203 CSc1c(ccc2c1cncc2)O 62a_200000210301_200010115057 [0,1,0,0,0,0|1,1,0]=3 248 B14R2.203 CSc1c(ccc2c1nccc2)O 62a_200000210301_100010173343 [0,1,0,0,0,0|1,1,0]=3 249 B14R2.203 CSc1c(cnc2c1cccc2)Br 62a_200000210301_200010179490 [0,1,0,0,0,0|2,1,0]=4 250 B14R2.203 CSc1c(cnc2c1cccc2)Br 62a_200010179490_200000210301 [0,1,0,0,0,0|2,1,0]=4 251 B14R2.203 CSc1c(cnc2c1cccc2)C 62a_200000210301_100000092342 [0,1,0,0,0,0|2,1,0]=4 252 B14R2.203 CSc1c(cnc2c1cccc2)N 62a_100009995561_200000210301 [0,1,0,0,0,0|2,1,0]=4 253 B14R2.203 CSc1c(cnc2c1cccc2)N 62a_200000210301_100012243074 [0,1,0,0,0,0|2,1,0]=4 254 B14R2.203 CSc1c(ncc2c1cccc2)N 62a_100009994184_200000210301 [0,1,0,0,0,0|2,1,0]=4 255 B14R2.203 CSc1c(ncc2c1cccc2)N 62a_200000210301_100009994184 [0,1,0,0,0,0|2,1,0]=4 256 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [0,1,0,0,0,0|2,0,0]=3 257 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [0,1,0,0,0,0|1,0,0]=2 258 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [0,1,0,0,0,0|1,0,0]=2 259 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [0,1,0,0,0,0|1,1,0]=3 260 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [0,1,0,0,0,0|1,1,0]=3 261 B14R2.203 Cc1ccc2cccnc2c1N[13CH3] 34a_100000065890_200025704644 [0,1,0,0,0,0|3,0,0]=4 262 B14R2.203 Cc1ccc2cnccc2c1S[13CH3] 62a_100010204589_200025704644 [0,1,0,0,0,0|2,1,0]=4 263 B14R2.203 Cc1ccc2cnccc2c1S[13CH3] 62a_200025704644_100010204589 [0,1,0,0,0,0|2,1,0]=4 264 B14R2.203 Cc1ccc2ncccc2c1N[13CH3] 34a_100011933972_200025704644 [0,1,0,0,0,0|3,0,0]=4 265 B14R2.203 Cc1cnc2ccccc2c1S[13CH3] 62a_200025704644_100000092342 [0,1,0,0,0,0|2,1,0]=4 266 B14R2.203 O=Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010090029 [0,1,0,0,0,0|0,0,1]=2 267 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [0,1,0,0,0,0|2,0,0]=3 268 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [0,1,0,0,0,0|2,0,0]=3 269 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [0,1,0,0,0,0|1,0,0]=2 270 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [0,1,0,0,0,0|1,0,0]=2 271 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [0,1,0,0,0,0|1,0,0]=2 272 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [0,1,0,0,0,0|1,0,0]=2 273 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Br 34a_100009816563_200025704644 [0,1,0,0,0,0|2,0,0]=3 274 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 34a_100000700379_200025704644 [0,1,0,0,0,0|2,0,0]=3 275 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 7a_100000700379_200025704644 [0,1,0,0,0,0|2,0,0]=3 276 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [0,1,0,0,0,0|1,1,0]=3 277 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [0,1,0,0,0,0|1,1,0]=3 278 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [0,1,0,0,0,0|1,1,0]=3 279 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [0,1,0,0,0,0|1,1,0]=3 280 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [0,1,0,0,0,0|0,1,0]=2 281 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200009995563_200025704644 [0,1,0,0,0,0|2,1,0]=4 282 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200025704644_200009995563 [0,1,0,0,0,0|2,1,0]=4 283 B14R2.203 [13CH3]Sc1c(ccc2c1ccnc2)F 62a_100010272212_200025704644 [0,1,0,0,0,0|2,1,0]=4 284 B14R2.203 [13CH3]Sc1c(ccc2c1ccnc2)F 62a_200025704644_100010272212 [0,1,0,0,0,0|2,1,0]=4 285 B14R2.203 [13CH3]Sc1c(ccc2c1ccnc2)N 62a_100010245214_200025704644 [0,1,0,0,0,0|2,1,0]=4 286 B14R2.203 [13CH3]Sc1c(ccc2c1ccnc2)N 62a_200025704644_100010245214 [0,1,0,0,0,0|2,1,0]=4 287 B14R2.203 [13CH3]Sc1c(ccc2c1cncc2)F 62a_200015767032_200025704644 [0,1,0,0,0,0|2,1,0]=4 288 B14R2.203 [13CH3]Sc1c(ccc2c1cncc2)F 62a_200025704644_200015767032 [0,1,0,0,0,0|2,1,0]=4 289 B14R2.203 [13CH3]Sc1c(ccc2c1cncc2)O 62a_200025704644_200010115057 [0,1,0,0,0,0|1,1,0]=3 290 B14R2.203 [13CH3]Sc1c(ccc2c1nccc2)O 62a_200025704644_100010173343 [0,1,0,0,0,0|1,1,0]=3 291 B14R2.203 [13CH3]Sc1c(cnc2c1cccc2)Br 62a_200010179490_200025704644 [0,1,0,0,0,0|2,1,0]=4 292 B14R2.203 [13CH3]Sc1c(cnc2c1cccc2)Br 62a_200025704644_200010179490 [0,1,0,0,0,0|2,1,0]=4 293 B14R2.203 [13CH3]Sc1c(cnc2c1cccc2)N 62a_100009995561_200025704644 [0,1,0,0,0,0|2,1,0]=4 294 B14R2.203 [13CH3]Sc1c(cnc2c1cccc2)N 62a_200025704644_100012243074 [0,1,0,0,0,0|2,1,0]=4 295 B14R2.203 [13CH3]Sc1c(ncc2c1cccc2)N 62a_100009994184_200025704644 [0,1,0,0,0,0|2,1,0]=4 296 B14R2.203 [13CH3]Sc1c(ncc2c1cccc2)N 62a_200025704644_100009994184 [0,1,0,0,0,0|2,1,0]=4 297 B14R2.4513 Cc1ccc2occ(c(=O)c2c1)O 271570a_203496583355_200010005421 [0,1,0,0,0,0|1,0,1]=3 298 B14R2.4513 Cn1c(=O)ccc2c1cc(cc2)O 271570a_203496583355_200010167779 [0,1,0,0,0,0|2,0,1]=4 299 B14R2.4513 Cn1ccc2ccc(cc2c1=O)O 271570a_203496583355_100010371002 [0,1,0,0,0,0|2,0,1]=4 300 B14R2.4513 O=c1c(c[nH]c2c1cc(cc2)Br)O 271570a_203496583355_100012348040 [0,1,0,0,0,0|1,0,1]=3 301 B14R2.4513 O=c1c(coc2c1cc(cc2)Cl)O 271570a_203496583355_200010204847 [0,1,0,0,0,0|1,0,1]=3 302 B14R2.4513 O=c1c(coc2c1cc(cc2)F)O 271570a_203496583355_200009813772 [0,1,0,0,0,0|1,0,1]=3 303 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [0,1,0,0,0,0|2,0,1]=4 304 B14R2.7724 Cn1cc(c2ccccc2c1=O)O 271570a_203496583355_100000239302 [0,1,0,0,0,0|2,0,1]=4 305 B14R2.7724 Oc1cc(c2cccnc2c1O)Cl 271570a_203496583355_100000211503 [0,1,0,0,0,0|1,0,0]=2 306 B14R2.7724 Oc1cc(c2ncccc2c1F)F 271570a_203496583355_200009817093 [0,1,0,0,0,0|2,0,0]=3 307 B14R2.8038 Cc1c(ccc2c1nccc2O)F 271570a_203496583355_100011516163 [0,1,0,0,0,0|3,0,0]=4 308 B14R2.8038 Cc1ccc2c(ccnc2c1C)O 271570a_203496583355_100011310510 [0,1,0,0,0,0|3,0,0]=4 309 B14R2.8038 Cc1ccc2c(nccc2c1O)N 271570a_203496583355_100010201667 [0,1,0,0,0,0|2,0,0]=3 310 B14R2.8038 O=c1c(c[nH]c2c1cccc2F)O 271570a_203496583355_100012351745 [0,1,0,0,0,0|1,0,1]=3 311 B14R2.8038 O=c1cc[nH]c2c1ccc(c2F)O 271570a_203496583355_100022010583 [0,1,0,0,0,0|2,0,0]=3 312 B14R2.8188 Cc1c(c(nc2c1cccc2)O)O 271570a_203496583355_100009820873 [0,1,0,0,0,0|2,0,0]=3 313 B14R2.8188 Oc1c(cc2ncccc2c1F)F 271570a_203496583355_100010163946 [0,1,0,0,0,0|2,0,0]=3 314 B14R2.28523 Cc1c(ccc2c1c(=O)[nH]cn2)O 271570a_203496583355_206256548267 [0,1,0,0,0,0|3,0,0]=4 315 B14R2.28523 Cn1ccc2cccc(c2c1=O)O 271570a_203496583355_100010332868 [0,1,0,0,0,0|2,0,1]=4 316 B14R2.29369 Cc1ccc2c(c(ccc2n1)F)O 271570a_203496583355_100010730238 [0,1,0,0,0,0|2,0,0]=3 317 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [0,1,0,0,0,0|1,0,0]=2 318 B14R2.29369 Cn1ccc2cc(ccc2c1=O)O 271570a_203496583355_100010246303 [0,1,0,0,0,0|2,0,1]=4 319 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [0,1,0,0,0,0|0,0,2]=3 320 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [0,1,0,0,0,0|1,0,0]=2 321 B12R1.25 C=CCNc1cccc(c1Br)O 34a_100012183704_100015514636 [0,0,1,0,0,0|2,0,1]=4 322 B12R1.25 C=CCNc1cccc(c1Br)O 7a_100012183704_100015514636 [0,0,1,0,0,0|2,0,1]=4 323 B12R1.25 C=CCNc1cccc(c1C)O 34a_100011216573_100015514636 [0,0,1,0,0,0|2,0,1]=4 324 B12R1.25 C=CCNc1cccc(c1C)O 7a_100011216573_100015514636 [0,0,1,0,0,0|2,0,1]=4 325 B12R1.25 C=CCNc1cccc(c1Cl)O 34a_100012002038_100015514636 [0,0,1,0,0,0|2,0,1]=4 326 B12R1.25 C=CCNc1cccc(c1Cl)O 7a_100012002038_100015514636 [0,0,1,0,0,0|2,0,1]=4 327 B12R1.25 C=CCNc1cccc(c1O)Br 34a_100011934915_100015514636 [0,0,1,0,0,0|2,0,1]=4 328 B12R1.25 C=CCNc1cccc(c1O)C 34a_100000756359_100015514636 [0,0,1,0,0,0|2,0,1]=4 329 B12R1.25 C=CCNc1cccc(c1O)Cl 34a_100000754742_100015514636 [0,0,1,0,0,0|2,0,1]=4 330 B12R1.25 C=CCNc1cccc(c1O)F 34a_100011934987_100015514636 [0,0,1,0,0,0|2,0,1]=4 331 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100000210623_100010187914 [0,0,1,0,0,0|2,0,1]=4 332 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100010187914_100000210623 [0,0,1,0,0,0|2,0,1]=4 333 B12R1.25 C=CCSc1cccc(c1C)O 62a_100000210623_100012002258 [0,0,1,0,0,0|2,0,1]=4 334 B12R1.25 C=CCSc1cccc(c1C)O 62a_100012002258_100000210623 [0,0,1,0,0,0|2,0,1]=4 335 B12R1.25 C=CCSc1cccc(c1Cl)O 62a_100000210623_100000049636 [0,0,1,0,0,0|2,0,1]=4 336 B12R1.25 C=CCSc1cccc(c1F)O 62a_100000210623_100009817021 [0,0,1,0,0,0|2,0,1]=4 337 B12R1.25 C=CCSc1cccc(c1F)O 62a_100009817021_100000210623 [0,0,1,0,0,0|2,0,1]=4 338 B12R1.25 C=CCSc1cccc(c1N)O 62a_100000210623_100011934926 [0,0,1,0,0,0|2,0,1]=4 339 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100000210623_100010084509 [0,0,1,0,0,0|2,0,1]=4 340 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100010084509_100000210623 [0,0,1,0,0,0|2,0,1]=4 341 B12R1.25 C=CCSc1cccc(c1O)C 62a_100000210623_100009817157 [0,0,1,0,0,0|2,0,1]=4 342 B12R1.25 C=CCSc1cccc(c1O)C 62a_100009817157_100000210623 [0,0,1,0,0,0|2,0,1]=4 343 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100000210623_100010202889 [0,0,1,0,0,0|2,0,1]=4 344 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100010202889_100000210623 [0,0,1,0,0,0|2,0,1]=4 345 B12R1.25 C=CCSc1cccc(c1O)F 62a_100000210623_100009813666 [0,0,1,0,0,0|2,0,1]=4 346 B12R1.25 C=CCSc1cccc(c1O)F 62a_100009813666_100000210623 [0,0,1,0,0,0|2,0,1]=4 347 B12R1.25 C=CCSc1cccc(c1O)N 62a_100000210623_100010084371 [0,0,1,0,0,0|2,0,1]=4 348 B12R1.25 C=CCSc1cccc(c1O)N 62a_100011934915_100000210623 [0,0,1,0,0,0|2,0,1]=4 349 B12R1.25 C=CCSc1cccc(c1O)O 62a_100000210623_100009815950 [0,0,1,0,0,0|1,0,1]=3 350 B12R1.25 O=CCSc1cccc(c1O)O 62a_200015260668_100009815950 [0,0,1,0,0,0|2,0,1]=4 351 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [0,0,1,0,0,0|1,0,2]=4 352 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [0,0,1,0,0,0|2,0,1]=4 353 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [0,0,1,0,0,0|2,0,1]=4 354 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [0,0,1,0,0,0|1,0,2]=4 355 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [0,0,1,0,0,0|1,0,2]=4 356 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [0,0,1,0,0,0|2,0,1]=4 357 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [0,0,1,0,0,0|2,0,1]=4 358 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [0,0,1,0,0,0|1,0,2]=4 359 B12R1.77 C=Cc1ccccc1C(=O)CF 1458a_100011830265_100015361967 [0,0,1,0,0,0|1,0,2]=4 360 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [0,0,1,0,0,0|2,0,1]=4 361 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [0,0,1,0,0,0|2,0,1]=4 362 B12R1.77 C=Cc1ccccc1C(=O)NN 271570a_100011290941_100000190081 [0,0,1,0,0,0|2,0,1]=4 363 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [0,0,1,0,0,0|2,0,1]=4 364 B12R1.77 C=Cc1ccccc1C(O)CN 271570a_100011290941_100011236429 [0,0,1,0,0,0|1,0,2]=4 365 B12R1.77 C=Cc1ccccc1[C@H](N)CO 271570a_100011290941_100161155918 [0,0,1,0,0,0|1,0,2]=4 366 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200000210301_200016268969 [0,0,1,0,0,0|2,0,1]=4 367 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200016268969_200000210301 [0,0,1,0,0,0|2,0,1]=4 368 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200016268969_200025704644 [0,0,1,0,0,0|2,0,1]=4 369 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200025704644_200016268969 [0,0,1,0,0,0|2,0,1]=4 370 B12R1.385 C=CCNc1ccc(c(c1)Br)O 34a_100011534360_100015514636 [0,0,1,0,0,0|2,0,1]=4 371 B12R1.385 C=CCNc1ccc(c(c1)C)O 34a_100011218179_100015514636 [0,0,1,0,0,0|2,0,1]=4 372 B12R1.385 C=CCNc1ccc(c(c1)C)O 7a_100011218179_100015514636 [0,0,1,0,0,0|2,0,1]=4 373 B12R1.385 C=CCNc1ccc(c(c1)Cl)O 34a_100000744943_100015514636 [0,0,1,0,0,0|2,0,1]=4 374 B12R1.385 C=CCNc1ccc(c(c1)F)O 34a_100011220035_100015514636 [0,0,1,0,0,0|2,0,1]=4 375 B12R1.385 C=CCNc1ccc(c(c1)F)O 7a_100011220035_100015514636 [0,0,1,0,0,0|2,0,1]=4 376 B12R1.385 C=CCNc1ccc(c(c1)O)C 34a_100000759471_100015514636 [0,0,1,0,0,0|2,0,1]=4 377 B12R1.385 C=CCNc1ccc(c(c1)O)C 7a_100000759471_100015514636 [0,0,1,0,0,0|2,0,1]=4 378 B12R1.385 C=CCNc1ccc(c(c1)O)Cl 34a_100011934209_100015514636 [0,0,1,0,0,0|2,0,1]=4 379 B12R1.385 C=CCNc1ccc(c(c1)O)F 34a_100012017398_100015514636 [0,0,1,0,0,0|2,0,1]=4 380 B12R1.385 C=CCNc1ccc(c(c1)O)F 7a_100012017398_100015514636 [0,0,1,0,0,0|2,0,1]=4 381 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [0,0,1,0,0,0|1,0,1]=3 382 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100000210623_100012361655 [0,0,1,0,0,0|2,0,1]=4 383 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210623 [0,0,1,0,0,0|2,0,1]=4 384 B12R1.385 C=CCSc1ccc(c(c1)C)O 62a_100000210623_100000186361 [0,0,1,0,0,0|2,0,1]=4 385 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100000210623_100012360047 [0,0,1,0,0,0|2,0,1]=4 386 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210623 [0,0,1,0,0,0|2,0,1]=4 387 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000185481_100000210623 [0,0,1,0,0,0|2,0,1]=4 388 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000210623_100000185481 [0,0,1,0,0,0|2,0,1]=4 389 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000210623_100000752626 [0,0,1,0,0,0|2,0,1]=4 390 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000752626_100000210623 [0,0,1,0,0,0|2,0,1]=4 391 B12R1.385 C=CCSc1ccc(c(c1)O)Br 62a_100000210623_100012356990 [0,0,1,0,0,0|2,0,1]=4 392 B12R1.385 C=CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210623 [0,0,1,0,0,0|2,0,1]=4 393 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000210623_100000685420 [0,0,1,0,0,0|2,0,1]=4 394 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000685420_100000210623 [0,0,1,0,0,0|2,0,1]=4 395 B12R1.385 C=CCSc1ccc(c(c1)O)Cl 62a_100000210623_100011356854 [0,0,1,0,0,0|2,0,1]=4 396 B12R1.385 C=CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210623 [0,0,1,0,0,0|2,0,1]=4 397 B12R1.385 C=CCSc1ccc(c(c1)O)F 62a_100000210623_100000686035 [0,0,1,0,0,0|2,0,1]=4 398 B12R1.385 C=CCSc1ccc(c(c1)O)F 62a_100000686035_100000210623 [0,0,1,0,0,0|2,0,1]=4 399 B12R1.385 C=CCSc1ccc(c(c1)O)N 62a_100000210623_100000739049 [0,0,1,0,0,0|2,0,1]=4 400 B12R1.385 C=CCSc1ccc(c(c1)O)N 62a_100000739049_100000210623 [0,0,1,0,0,0|2,0,1]=4 401 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [0,0,1,0,0,0|1,0,1]=3 402 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [0,0,1,0,0,0|2,0,1]=4 403 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [0,0,1,0,0,0|2,0,1]=4 404 B12R1.497 C=C=Cc1c(ccc(c1C)O)C 271570a_100015277604_100010659238 [0,0,1,0,0,0|1,0,2]=4 405 B12R1.497 C=C=Cc1c(ccc(c1O)F)C 271570a_100015277604_200010223207 [0,0,1,0,0,0|1,0,2]=4 406 B12R1.497 C=C=Cc1c(ccc(c1O)F)F 271570a_100015277604_100010170822 [0,0,1,0,0,0|2,0,1]=4 407 B12R1.497 CC=Cc1c(ccc(c1C)O)C 271570a_100016259895_100010659238 [0,0,1,0,0,0|1,0,2]=4 408 B12R1.497 CC=Cc1c(ccc(c1O)F)C 271570a_100016259895_200010223207 [0,0,1,0,0,0|1,0,2]=4 409 B12R1.497 CC=Cc1c(ccc(c1O)F)F 271570a_100016259895_100010170822 [0,0,1,0,0,0|2,0,1]=4 410 B12R1.544 C=C=Cc1ccc(c(c1C)C)O 271570a_100015277604_100012353674 [0,0,1,0,0,0|1,0,2]=4 411 B12R1.544 C=C=Cc1ccc(c(c1C)N)O 271570a_100015277604_100013039247 [0,0,1,0,0,0|1,0,2]=4 412 B12R1.544 C=C=Cc1ccc(c(c1F)C)O 271570a_100015277604_100010390934 [0,0,1,0,0,0|2,0,1]=4 413 B12R1.544 C=C=Cc1ccc(c(c1F)F)O 271570a_100015277604_100011830415 [0,0,1,0,0,0|2,0,1]=4 414 B12R1.544 C=C=Cc1ccc(c(c1F)O)Br 271570a_100015277604_200010782288 [0,0,1,0,0,0|2,0,1]=4 415 B12R1.544 C=C=Cc1ccc(c(c1F)O)F 271570a_100015277604_100010167067 [0,0,1,0,0,0|2,0,1]=4 416 B12R1.544 C=C=Cc1ccc(c(c1N)O)Br 271570a_100015277604_100020748643 [0,0,1,0,0,0|2,0,1]=4 417 B12R1.544 CC=Cc1ccc(c(c1C)C)O 271570a_100016259895_100012353674 [0,0,1,0,0,0|1,0,2]=4 418 B12R1.544 CC=Cc1ccc(c(c1C)N)O 271570a_100016259895_100013039247 [0,0,1,0,0,0|1,0,2]=4 419 B12R1.544 CC=Cc1ccc(c(c1F)C)O 271570a_100016259895_100010390934 [0,0,1,0,0,0|2,0,1]=4 420 B12R1.544 CC=Cc1ccc(c(c1F)F)O 271570a_100016259895_100011830415 [0,0,1,0,0,0|2,0,1]=4 421 B12R1.544 CC=Cc1ccc(c(c1F)O)Br 271570a_100016259895_200010782288 [0,0,1,0,0,0|2,0,1]=4 422 B12R1.544 CC=Cc1ccc(c(c1F)O)F 271570a_100016259895_100010167067 [0,0,1,0,0,0|2,0,1]=4 423 B12R1.544 CC=Cc1ccc(c(c1N)O)Br 271570a_100016259895_100020748643 [0,0,1,0,0,0|2,0,1]=4 424 B12R1.652 C=Cc1c(ccc(c1C)F)C=O 271570a_100011290941_100009872231 [0,0,1,0,0,0|3,0,0]=4 425 B12R1.652 C=Cc1c(ccc(c1F)F)C=O 271570a_100011290941_100015087033 [0,0,1,0,0,0|3,0,0]=4 426 B12R1.652 C=Cc1ccc(c(c1C=O)F)C 271570a_100011290941_100000039034 [0,0,1,0,0,0|3,0,0]=4 427 B12R1.652 C=Cc1ccc(c(c1C=O)F)F 271570a_100011290941_100009814791 [0,0,1,0,0,0|3,0,0]=4 428 B12R1.652 C=Cc1ccc(c(c1OC)O)F 271570a_100011290941_200010167157 [0,0,1,0,0,0|2,0,1]=4 429 B12R1.652 CSc1c(ccc(c1O)O)C=O 62a_200000210301_200010659824 [0,0,1,0,0,0|2,0,1]=4 430 B12R1.652 [13CH3]Sc1c(ccc(c1O)O)C=O 62a_200025704644_200010659824 [0,0,1,0,0,0|2,0,1]=4 431 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,0,0,0,1,0|2,0,0]=3 432 B12R2.18 Cc1nc2ccccn2c1O 271570a_203496583355_100009816614 [0,0,0,0,1,0|3,0,0]=4 433 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,0,0,0,1,0|2,0,0]=3 434 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,0,0,0,1,0|2,0,0]=3 435 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [0,0,0,0,1,0|3,0,0]=4 436 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,0,0,0,1,0|3,0,0]=4 437 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,0,0,0,1,0|2,0,0]=3 438 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [0,0,0,0,1,0|2,0,0]=3 439 B12R2.82 Cc1c(ccc2c1cn[nH]2)O 271570a_203496583355_100009817094 [0,0,0,0,1,0|3,0,0]=4 440 B12R2.82 Cc1c(ccc2c1nc[nH]2)O 271570a_203496583355_100010009745 [0,0,0,0,1,0|3,0,0]=4 441 B12R2.82 Cc1c(ccc2n1ccn2)O 271570a_203496583355_100012569086 [0,0,0,0,1,0|3,0,0]=4 442 B12R2.82 Cc1c(ccc2n1ncc2)O 271570a_203496583355_100010767214 [0,0,0,0,1,0|3,0,0]=4 443 B12R2.82 Cc1c(cnc2c1cc[nH]2)O 271570a_203496583355_100010254266 [0,0,0,0,1,0|3,0,0]=4 444 B12R2.82 Cc1c(ncc2c1[nH]cc2)O 271570a_203496583355_100010244392 [0,0,0,0,1,0|3,0,0]=4 445 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,0,0,0,1,0|2,0,0]=3 446 B12R2.82 Cc1ccc2[nH]ncc2c1O 271570a_203496583355_100009817104 [0,0,0,0,1,0|3,0,0]=4 447 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,0,0,0,1,0|2,0,0]=3 448 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,0,0,0,1,0|3,0,0]=4 449 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [0,0,0,0,1,0|3,0,0]=4 450 B12R2.82 Cc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097406 [0,0,0,0,1,0|3,0,0]=4 451 B12R2.82 Cc1ncc2[nH]ccc2c1O 271570a_203496583355_100011015088 [0,0,0,0,1,0|3,0,0]=4 452 B12R2.82 Nc1c(ccc2c1cn[nH]2)O 271570a_203496583355_100020965837 [0,0,0,0,1,0|3,0,0]=4 453 B12R2.82 Nc1c(ccc2c1scn2)O 271570a_203496583355_100010998030 [0,0,0,0,1,0|3,0,0]=4 454 B12R2.82 Nc1c(cnc2c1cc[nH]2)O 271570a_203496583355_100010168494 [0,0,0,0,1,0|3,0,0]=4 455 B12R2.82 Nc1ccc2[nH]cnc2c1O 271570a_203496583355_100009816657 [0,0,0,0,1,0|3,0,0]=4 456 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,0,0,0,1,0|3,0,0]=4 457 B12R2.82 Nc1ccc2scnc2c1O 271570a_203496583355_100009816736 [0,0,0,0,1,0|3,0,0]=4 458 B12R2.82 O=c1c(c[nH]c2c1scc2)O 271570a_203496583355_100012569241 [0,0,0,0,1,0|2,0,1]=4 459 B12R2.82 Oc1c(ccc2c1[nH]nc2)F 271570a_203496583355_100010762478 [0,0,0,0,1,0|3,0,0]=4 460 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,0,0,0,1,0|2,0,0]=3 461 B12R2.82 Oc1c(ccc2c1cn[nH]2)F 271570a_203496583355_200010080415 [0,0,0,0,1,0|3,0,0]=4 462 B12R2.82 Oc1c(ccc2c1nc[nH]2)F 271570a_203496583355_200010369618 [0,0,0,0,1,0|3,0,0]=4 463 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,0,0,0,1,0|3,0,0]=4 464 B12R2.82 Oc1c(cnc2c1[nH]cc2)F 271570a_203496583355_100009883597 [0,0,0,0,1,0|3,0,0]=4 465 B12R2.82 Oc1c(cnc2c1cc[nH]2)F 271570a_203496583355_100000118126 [0,0,0,0,1,0|3,0,0]=4 466 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [0,0,0,0,1,0|2,0,0]=3 467 B12R2.82 Oc1ccc2[nH]ncc2c1F 271570a_203496583355_100010232219 [0,0,0,0,1,0|3,0,0]=4 468 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [0,0,0,0,1,0|0,0,3]=4 469 B12R2.82 Oc1ccc2cn[nH]c2c1F 271570a_203496583355_100102525427 [0,0,0,0,1,0|3,0,0]=4 470 B12R2.82 Oc1cnc2[nH]ccc2c1Cl 271570a_203496583355_100010219237 [0,0,0,0,1,0|3,0,0]=4 471 B12R2.82 Oc1cnc2[nH]ccc2c1F 271570a_203496583355_100011012301 [0,0,0,0,1,0|3,0,0]=4 472 B11R1.13 C=C=Cc1cccc(c1Br)O 271570a_100015277604_100010187914 [1,0,1,0,0,0|1,0,1]=4 473 B11R1.13 C=C=Cc1cccc(c1C)O 271570a_100015277604_100012002258 [1,0,1,0,0,0|0,0,2]=4 474 B11R1.13 C=C=Cc1cccc(c1Cl)O 271570a_100015277604_100000049636 [1,0,1,0,0,0|1,0,1]=4 475 B11R1.13 C=C=Cc1cccc(c1F)O 271570a_100015277604_100009817021 [1,0,1,0,0,0|1,0,1]=4 476 B11R1.13 C=C=Cc1cccc(c1N)O 271570a_100015277604_100011934926 [1,0,1,0,0,0|1,0,1]=4 477 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [1,0,1,0,0,0|1,0,1]=4 478 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [1,0,1,0,0,0|1,0,1]=4 479 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [1,0,1,0,0,0|1,0,1]=4 480 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [1,0,1,0,0,0|1,0,1]=4 481 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [1,0,1,0,0,0|1,0,1]=4 482 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [1,0,1,0,0,0|0,0,1]=3 483 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,0,1,0,0,0|1,0,1]=4 484 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,0,1,0,0,0|0,0,2]=4 485 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,0,1,0,0,0|1,0,1]=4 486 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,0,1,0,0,0|1,0,1]=4 487 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,0,1,0,0,0|1,0,1]=4 488 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [1,0,1,0,0,0|1,0,1]=4 489 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [1,0,1,0,0,0|1,0,1]=4 490 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [1,0,1,0,0,0|1,0,1]=4 491 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [1,0,1,0,0,0|1,0,1]=4 492 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [1,0,1,0,0,0|1,0,1]=4 493 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,0,1,0,0,0|0,0,1]=3 494 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [1,0,1,0,0,0|1,0,1]=4 495 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [1,0,1,0,0,0|1,0,1]=4 496 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [1,0,1,0,0,0|1,0,1]=4 497 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,0,1,0,0,0|1,0,1]=4 498 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,0,1,0,0,0|1,0,1]=4 499 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [1,0,1,0,0,0|0,0,2]=4 500 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [1,0,1,0,0,0|0,0,2]=4 501 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [1,0,1,0,0,0|0,0,2]=4 502 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [1,0,1,0,0,0|0,0,2]=4 503 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [1,0,1,0,0,0|0,0,2]=4 504 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [1,0,1,0,0,0|1,0,1]=4 505 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [1,0,1,0,0,0|1,0,1]=4 506 B11R1.41 C=C=Cc1ccccc1C=O 271570a_100015277604_100000211189 [1,0,1,0,0,0|0,0,2]=4 507 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [1,0,1,0,0,0|0,0,2]=4 508 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [1,0,1,0,0,0|1,0,1]=4 509 B11R1.41 C=Cc1ccccc1CCO 271570a_100011290941_100000731337 [1,0,1,0,0,0|0,0,2]=4 510 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [1,0,1,0,0,0|0,0,2]=4 511 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [1,0,1,0,0,0|0,0,2]=4 512 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [1,0,1,0,0,0|2,0,0]=4 513 B11R1.53 C=Cc1ccccc1B(O)O 271570a_100011290941_100000693059 [1,0,1,0,0,0|1,0,0]=3 514 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [1,0,1,0,0,0|0,0,2]=4 515 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [1,0,1,0,0,0|0,0,2]=4 516 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [1,0,1,0,0,0|1,0,1]=4 517 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [1,0,1,0,0,0|0,0,2]=4 518 B11R1.53 C=Cc1ccccc1C(C)O 271570a_100011290941_100000702211 [1,0,1,0,0,0|0,0,2]=4 519 B11R1.53 C=Cc1cnccc1B(O)O 271570a_100011290941_200010176179 [1,0,1,0,0,0|2,0,0]=4 520 B11R1.53 C=Cc1ncccc1B(O)O 271570a_100011290941_100009815992 [1,0,1,0,0,0|2,0,0]=4 521 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [1,0,1,0,0,0|1,0,1]=4 522 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [1,0,1,0,0,0|1,0,1]=4 523 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [1,0,1,0,0,0|1,0,1]=4 524 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [1,0,1,0,0,0|1,0,1]=4 525 B11R1.192 C=C=Cc1ccc(c(c1)Br)O 271570a_100015277604_100012361655 [1,0,1,0,0,0|1,0,1]=4 526 B11R1.192 C=C=Cc1ccc(c(c1)C)O 271570a_100015277604_100000186361 [1,0,1,0,0,0|1,0,1]=4 527 B11R1.192 C=C=Cc1ccc(c(c1)Cl)O 271570a_100015277604_100012360047 [1,0,1,0,0,0|1,0,1]=4 528 B11R1.192 C=C=Cc1ccc(c(c1)F)O 271570a_100015277604_100000185481 [1,0,1,0,0,0|1,0,1]=4 529 B11R1.192 C=C=Cc1ccc(c(c1)N)O 271570a_100015277604_100000752626 [1,0,1,0,0,0|1,0,1]=4 530 B11R1.192 C=C=Cc1ccc(c(c1)O)Br 271570a_100015277604_100012356990 [1,0,1,0,0,0|1,0,1]=4 531 B11R1.192 C=C=Cc1ccc(c(c1)O)C 271570a_100015277604_100000766334 [1,0,1,0,0,0|1,0,1]=4 532 B11R1.192 C=C=Cc1ccc(c(c1)O)Cl 271570a_100015277604_100011356854 [1,0,1,0,0,0|1,0,1]=4 533 B11R1.192 C=C=Cc1ccc(c(c1)O)F 271570a_100015277604_100000686035 [1,0,1,0,0,0|1,0,1]=4 534 B11R1.192 C=C=Cc1ccc(c(c1)O)N 271570a_100015277604_100000739049 [1,0,1,0,0,0|1,0,1]=4 535 B11R1.192 C=C=Cc1ccc(c(c1)O)O 271570a_100015277604_100009813601 [1,0,1,0,0,0|0,0,1]=3 536 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,0,1,0,0,0|1,0,1]=4 537 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,0,1,0,0,0|1,0,1]=4 538 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,0,1,0,0,0|1,0,1]=4 539 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,0,1,0,0,0|1,0,1]=4 540 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,0,1,0,0,0|1,0,1]=4 541 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,0,1,0,0,0|1,0,1]=4 542 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,0,1,0,0,0|1,0,1]=4 543 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,0,1,0,0,0|1,0,1]=4 544 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,0,1,0,0,0|1,0,1]=4 545 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,0,1,0,0,0|1,0,1]=4 546 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,0,1,0,0,0|0,0,1]=3 547 B11R1.72 C=Cc1c(ccc(c1C)O)C 271570a_100011290941_100010659238 [1,0,1,0,0,0|1,0,1]=4 548 B11R1.72 C=Cc1c(ccc(c1O)F)C 271570a_100011290941_200010223207 [1,0,1,0,0,0|1,0,1]=4 549 B11R1.72 C=Cc1c(ccc(c1O)F)F 271570a_100011290941_100010170822 [1,0,1,0,0,0|2,0,0]=4 550 B11R1.72 O=Cc1c(ccc(c1O)O)O 271570a_203496583355_100010184888 [1,0,1,0,0,0|2,0,0]=4 551 B11R1.182 C=C=Cc1cc(ccc1Br)O 271570a_100015277604_100012339312 [1,0,1,0,0,0|1,0,1]=4 552 B11R1.182 C=C=Cc1cc(ccc1C)O 271570a_100015277604_100011380479 [1,0,1,0,0,0|0,0,2]=4 553 B11R1.182 C=C=Cc1cc(ccc1Cl)O 271570a_100015277604_100000049588 [1,0,1,0,0,0|1,0,1]=4 554 B11R1.182 C=C=Cc1cc(ccc1F)O 271570a_100015277604_100000693481 [1,0,1,0,0,0|1,0,1]=4 555 B11R1.182 C=C=Cc1cc(ccc1N)O 271570a_100015277604_100012001276 [1,0,1,0,0,0|1,0,1]=4 556 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [1,0,1,0,0,0|1,0,1]=4 557 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [1,0,1,0,0,0|1,0,1]=4 558 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [1,0,1,0,0,0|0,0,2]=4 559 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [1,0,1,0,0,0|1,0,1]=4 560 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [1,0,1,0,0,0|1,0,1]=4 561 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [1,0,1,0,0,0|1,0,1]=4 562 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,0,1,0,0,0|1,0,1]=4 563 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [1,0,1,0,0,0|1,0,1]=4 564 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [1,0,1,0,0,0|1,0,1]=4 565 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [1,0,1,0,0,0|1,0,1]=4 566 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [1,0,1,0,0,0|0,0,2]=4 567 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [1,0,1,0,0,0|1,0,1]=4 568 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [1,0,1,0,0,0|1,0,1]=4 569 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [1,0,1,0,0,0|1,0,1]=4 570 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [1,0,1,0,0,0|1,0,1]=4 571 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [1,0,1,0,0,0|1,0,1]=4 572 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [1,0,1,0,0,0|0,0,2]=4 573 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [1,0,1,0,0,0|1,0,1]=4 574 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [1,0,1,0,0,0|1,0,1]=4 575 B11R1.81 C=C=Cc1ccc(cc1Br)O 271570a_100015277604_100000701344 [1,0,1,0,0,0|1,0,1]=4 576 B11R1.81 C=C=Cc1ccc(cc1C)O 271570a_100015277604_100000729255 [1,0,1,0,0,0|0,0,2]=4 577 B11R1.81 C=C=Cc1ccc(cc1Cl)O 271570a_100015277604_100000047559 [1,0,1,0,0,0|1,0,1]=4 578 B11R1.81 C=C=Cc1ccc(cc1F)O 271570a_100015277604_100000755031 [1,0,1,0,0,0|1,0,1]=4 579 B11R1.81 C=C=Cc1ccc(cc1N)O 271570a_100015277604_100011999798 [1,0,1,0,0,0|1,0,1]=4 580 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [1,0,1,0,0,0|1,0,1]=4 581 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [1,0,1,0,0,0|1,0,1]=4 582 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [1,0,1,0,0,0|0,0,2]=4 583 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [1,0,1,0,0,0|1,0,1]=4 584 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [1,0,1,0,0,0|1,0,1]=4 585 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [1,0,1,0,0,0|1,0,1]=4 586 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [1,0,1,0,0,0|1,0,1]=4 587 B11R1.278 C=Cc1ccc(c(c1C)C)O 271570a_100011290941_100012353674 [1,0,1,0,0,0|1,0,1]=4 588 B11R1.278 C=Cc1ccc(c(c1C)N)O 271570a_100011290941_100013039247 [1,0,1,0,0,0|1,0,1]=4 589 B11R1.278 C=Cc1ccc(c(c1F)C)O 271570a_100011290941_100010390934 [1,0,1,0,0,0|2,0,0]=4 590 B11R1.278 C=Cc1ccc(c(c1F)F)O 271570a_100011290941_100011830415 [1,0,1,0,0,0|2,0,0]=4 591 B11R1.278 C=Cc1ccc(c(c1F)O)Br 271570a_100011290941_200010782288 [1,0,1,0,0,0|2,0,0]=4 592 B11R1.278 C=Cc1ccc(c(c1F)O)F 271570a_100011290941_100010167067 [1,0,1,0,0,0|2,0,0]=4 593 B11R1.278 C=Cc1ccc(c(c1N)O)Br 271570a_100011290941_100020748643 [1,0,1,0,0,0|2,0,0]=4 594 B11R1.37 C=Cc1cc(ccc1C#N)O 271570a_100011290941_100012184851 [1,0,1,0,0,0|1,0,1]=4 595 B11R1.37 C=Cc1cc(ccc1C=O)Br 271570a_100011290941_100010146562 [1,0,1,0,0,0|2,0,0]=4 596 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [1,0,1,0,0,0|2,0,0]=4 597 B11R1.37 C=Cc1cc(ccc1C=O)F 271570a_100011290941_100000752949 [1,0,1,0,0,0|2,0,0]=4 598 B11R1.37 C=Cc1cc(ccc1C=O)O 271570a_100011290941_100011236494 [1,0,1,0,0,0|1,0,0]=3 599 B11R1.37 C=Cc1cc(ccc1CO)O 271570a_100011290941_100010146404 [1,0,1,0,0,0|1,0,1]=4 600 B11R1.37 C=Cc1cc(ccc1OC)O 271570a_100011290941_100010084122 [1,0,1,0,0,0|1,0,1]=4 601 B11R1.37 C=Cc1ccc(cc1C#N)O 271570a_100011290941_100009818209 [1,0,1,0,0,0|1,0,1]=4 602 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [1,0,1,0,0,0|2,0,0]=4 603 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [1,0,1,0,0,0|2,0,0]=4 604 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [1,0,1,0,0,0|2,0,0]=4 605 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [1,0,1,0,0,0|2,0,0]=4 606 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [1,0,1,0,0,0|1,0,0]=3 607 B11R1.37 C=Cc1ccc(cc1CO)O 271570a_100011290941_100012351483 [1,0,1,0,0,0|1,0,1]=4 608 B11R1.37 C=Cc1ccc(cc1OC)O 271570a_100011290941_100011827694 [1,0,1,0,0,0|1,0,1]=4 609 B11R1.37 O=Cc1ccc(cc1C=O)O 271570a_203496583355_200010077131 [1,0,1,0,0,0|2,0,0]=4 610 B11R1.265 C=Cc1c(cccc1C#N)O 271570a_100011290941_100009818990 [1,0,1,0,0,0|1,0,1]=4 611 B11R1.265 C=Cc1c(cccc1C=O)F 271570a_100011290941_100011998484 [1,0,1,0,0,0|2,0,0]=4 612 B11R1.265 C=Cc1c(cccc1C=O)O 271570a_100011290941_100009816417 [1,0,1,0,0,0|1,0,0]=3 613 B11R1.265 C=Cc1c(cccc1OC)O 271570a_100011290941_100010202623 [1,0,1,0,0,0|1,0,1]=4 614 B11R1.265 C=Cc1cccc(c1C#N)O 271570a_100011290941_100012180507 [1,0,1,0,0,0|1,0,1]=4 615 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [1,0,1,0,0,0|2,0,0]=4 616 B11R1.265 C=Cc1cccc(c1C=O)Cl 271570a_100011290941_100010147682 [1,0,1,0,0,0|2,0,0]=4 617 B11R1.265 C=Cc1cccc(c1C=O)F 271570a_100011290941_100000210083 [1,0,1,0,0,0|2,0,0]=4 618 B11R1.265 C=Cc1cccc(c1C=O)N 271570a_100011290941_100010232536 [1,0,1,0,0,0|2,0,0]=4 619 B11R1.265 C=Cc1cccc(c1C=O)O 271570a_100011290941_100009814793 [1,0,1,0,0,0|1,0,0]=3 620 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [1,0,1,0,0,0|1,0,1]=4 621 B11R1.265 C=Cc1nccc(c1C=O)O 271570a_100011290941_200010729673 [1,0,1,0,0,0|2,0,0]=4 622 B13R1.12 C=CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210623 [0,1,1,0,0,0|1,0,1]=4 623 B13R1.12 C=CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210623 [0,1,1,0,0,0|1,0,1]=4 624 B13R1.12 C=CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210623 [0,1,1,0,0,0|1,0,1]=4 625 B13R1.12 C=CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210623 [0,1,1,0,0,0|1,0,1]=4 626 B13R1.12 C=CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210623 [0,1,1,0,0,0|1,0,1]=4 627 B13R1.12 C=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210623 [0,1,1,0,0,0|1,0,1]=4 628 B13R1.12 C=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210623 [0,1,1,0,0,0|1,0,1]=4 629 B13R1.12 C=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210623 [0,1,1,0,0,0|1,0,1]=4 630 B13R1.12 C=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210623 [0,1,1,0,0,0|1,0,1]=4 631 B13R1.12 C=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210623 [0,1,1,0,0,0|0,0,1]=3 632 B13R1.16 C/C=C/CSc1cccc(c1O)O 62a_100102629194_100009815950 [0,1,1,0,0,0|0,0,2]=4 633 B13R1.16 C=CCCSc1cccc(c1O)O 62a_100000754431_100009815950 [0,1,1,0,0,0|0,0,2]=4 634 B13R1.16 CC=CCSc1cccc(c1O)O 62a_100000070051_100009815950 [0,1,1,0,0,0|0,0,2]=4 635 B13R1.16 CCCC=Cc1cccc(c1O)O 271570a_100016258520_100009815950 [0,1,1,0,0,0|0,0,2]=4 636 B13R1.16 CCOC=Cc1cccc(c1O)O 271570a_100016256518_100009815950 [0,1,1,0,0,0|0,0,2]=4 637 B13R1.16 COCC=Cc1cccc(c1O)O 271570a_100016286323_100009815950 [0,1,1,0,0,0|0,0,2]=4 638 B13R1.40 C=CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000185746 [0,1,1,0,0,0|2,0,0]=4 639 B13R1.40 C=CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000185746 [0,1,1,0,0,0|2,0,0]=4 640 B13R1.40 C=CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000185746 [0,1,1,0,0,0|2,0,0]=4 641 B13R1.40 C=CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000185746 [0,1,1,0,0,0|2,0,0]=4 642 B13R1.40 C=CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000185746 [0,1,1,0,0,0|2,0,0]=4 643 B13R1.40 C=CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000185746 [0,1,1,0,0,0|2,0,0]=4 644 B13R1.40 C=CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000185746 [0,1,1,0,0,0|2,0,0]=4 645 B13R1.40 C=CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000185746 [0,1,1,0,0,0|2,0,0]=4 646 B13R1.40 C=CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000185746 [0,1,1,0,0,0|2,0,0]=4 647 B13R1.40 C=CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000185746 [0,1,1,0,0,0|2,0,0]=4 648 B13R1.40 C=CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000185746 [0,1,1,0,0,0|2,0,0]=4 649 B13R1.40 C=CC(C)Sc1cccc(c1O)O 62a_100011215867_100009815950 [0,1,1,0,0,0|1,0,1]=4 650 B13R1.150 C=C(C)CSc1cccc(c1O)O 62a_100000748629_100009815950 [0,1,1,0,0,0|1,0,1]=4 651 B13R1.150 C=C(F)CSc1cccc(c1O)O 62a_100000042424_100009815950 [0,1,1,0,0,0|1,0,1]=4 652 B13R1.150 CC(C)C=Cc1cccc(c1O)O 271570a_100016257149_100009815950 [0,1,1,0,0,0|0,0,2]=4 653 B13R1.150 CC(O)C=Cc1cccc(c1O)O 271570a_200011019289_100009815950 [0,1,1,0,0,0|0,0,2]=4 654 B13R1.569 C=CCNc1cccc(c1O)OC 34a_100000123586_100015514636 [0,1,1,0,0,0|1,0,1]=4 655 B13R1.569 C=CCSc1cccc(c1O)OC 62a_100000210623_100000686866 [0,1,1,0,0,0|1,0,1]=4 656 B13R1.3516 C=CCSc1cccc(c1OC)O 62a_100000210623_100010234590 [0,1,1,0,0,0|1,0,1]=4 657 B13R1.42 C=CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210623 [0,1,1,0,0,0|1,0,1]=4 658 B13R1.42 O=C(C=Cc1ccccc1)CCO 1458a_100000210462_100000211926 [0,1,1,0,0,0|0,0,2]=4 659 B13R1.47 C=CCC(=O)C(=C)c1ccccc1 1458a_100000065200_100000210623 [0,1,1,0,0,0|1,0,1]=4 660 B13R1.47 C=CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210623 [0,1,1,0,0,0|0,0,2]=4 661 B13R1.464 C=CCC(=O)c1ccccc1C=C 1458a_100011830265_100000210623 [0,1,1,0,0,0|1,0,1]=4 662 B13R1.464 C=Cc1ccccc1C(=O)CCO 1458a_100011830265_100000211926 [0,1,1,0,0,0|0,0,2]=4 663 B13R1.84 COCC=Cc1ccccc1C=O 271570a_100016286323_100000211189 [0,1,1,0,0,0|0,0,2]=4 664 B13R1.84 COCC=Cc1ccccc1CO 271570a_100016286323_100000187465 [0,1,1,0,0,0|0,0,2]=4 665 B13R1.90 CC(O)C=Cc1ccccc1C=O 271570a_200011019289_100000211189 [0,1,1,0,0,0|0,0,2]=4 666 B13R1.90 CC(O)C=Cc1ccccc1CO 271570a_200011019289_100000187465 [0,1,1,0,0,0|0,0,2]=4 667 B13R1.136 C=CCSc1cc(c(c(c1)F)O)O 62a_100000210623_100010114375 [0,1,1,0,0,0|1,0,1]=4 668 B13R1.136 C=CCSc1cc(c(c(c1)O)O)O 62a_100000210623_100010658518 [0,1,1,0,0,0|1,0,1]=4 669 B13R1.466 C=CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210623 [0,1,1,0,0,0|1,0,1]=4 670 B13R1.466 C=CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210623 [0,1,1,0,0,0|1,0,1]=4 671 B13R1.466 C=CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210623 [0,1,1,0,0,0|1,0,1]=4 672 B13R1.466 C=CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210623 [0,1,1,0,0,0|1,0,1]=4 673 B13R1.466 C=CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210623 [0,1,1,0,0,0|1,0,1]=4 674 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210623 [0,1,1,0,0,0|1,0,1]=4 675 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210623 [0,1,1,0,0,0|1,0,1]=4 676 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210623 [0,1,1,0,0,0|1,0,1]=4 677 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210623 [0,1,1,0,0,0|1,0,1]=4 678 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210623 [0,1,1,0,0,0|1,0,1]=4 679 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210623 [0,1,1,0,0,0|0,0,1]=3 680 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [0,1,1,0,0,0|1,0,1]=4 681 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [0,1,1,0,0,0|1,0,1]=4 682 B13R1.511 C=C(F)CNc1ccc(c(c1)O)O 34a_100102946323_100009893438 [0,1,1,0,0,0|1,0,1]=4 683 B13R1.511 C=C(F)CSc1ccc(c(c1)O)O 62a_100000042424_100009813601 [0,1,1,0,0,0|1,0,1]=4 684 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200000210301 [0,1,1,0,0,0|1,0,1]=4 685 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200000210301 [0,1,1,0,0,0|1,0,1]=4 686 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)O 271570a_100016257149_100009813601 [0,1,1,0,0,0|0,0,2]=4 687 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O 271570a_200011019289_100009813601 [0,1,1,0,0,0|0,0,2]=4 688 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200025704644 [0,1,1,0,0,0|1,0,1]=4 689 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200025704644 [0,1,1,0,0,0|1,0,1]=4 690 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [0,1,1,0,0,0|1,0,1]=4 691 B13R1.575 C=CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210623 [0,1,1,0,0,0|1,0,1]=4 692 B13R1.575 C=CCSc1ccc(c(c1)CO)O 62a_100000210623_100000184703 [0,1,1,0,0,0|1,0,1]=4 693 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [0,1,1,0,0,0|1,0,1]=4 694 B13R1.577 C=CCNc1ccc(c(c1)O)OC 34a_100000211920_100015514636 [0,1,1,0,0,0|1,0,1]=4 695 B13R1.577 C=CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210623 [0,1,1,0,0,0|1,0,1]=4 696 B13R1.577 C=CCSc1ccc(c(c1)O)CO 62a_100000210623_100000071718 [0,1,1,0,0,0|1,0,1]=4 697 B13R1.577 C=CCSc1ccc(c(c1)O)OC 62a_100000210623_100009816560 [0,1,1,0,0,0|1,0,1]=4 698 B13R1.669 C/C=C/CNc1ccc(c(c1)O)O 34a_100102946323_100102629194 [0,1,1,0,0,0|0,0,2]=4 699 B13R1.669 C/C=C/CSc1ccc(c(c1)O)O 62a_100102629194_100009813601 [0,1,1,0,0,0|0,0,2]=4 700 B13R1.669 C=CCCNc1ccc(c(c1)O)O 34a_100102946323_100000754431 [0,1,1,0,0,0|0,0,2]=4 701 B13R1.669 C=CCCSc1ccc(c(c1)O)O 62a_100000754431_100009813601 [0,1,1,0,0,0|0,0,2]=4 702 B13R1.669 C=CCNCc1ccc(c(c1)O)O 34a_100000010075_100015514636 [0,1,1,0,0,0|0,0,2]=4 703 B13R1.669 CC=CCNc1ccc(c(c1)O)O 34a_100102946323_100000070051 [0,1,1,0,0,0|0,0,2]=4 704 B13R1.669 CC=CCSc1ccc(c(c1)O)O 62a_100000070051_100009813601 [0,1,1,0,0,0|0,0,2]=4 705 B13R1.669 CCCC=Cc1ccc(c(c1)O)O 271570a_100016258520_100009813601 [0,1,1,0,0,0|0,0,2]=4 706 B13R1.669 CCOC=Cc1ccc(c(c1)O)O 271570a_100016256518_100009813601 [0,1,1,0,0,0|0,0,2]=4 707 B13R1.669 COCC=Cc1ccc(c(c1)O)O 271570a_100016286323_100009813601 [0,1,1,0,0,0|0,0,2]=4 708 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000185746 [0,1,1,0,0,0|2,0,0]=4 709 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000185746 [0,1,1,0,0,0|2,0,0]=4 710 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000185746 [0,1,1,0,0,0|2,0,0]=4 711 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000185746 [0,1,1,0,0,0|2,0,0]=4 712 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000185746 [0,1,1,0,0,0|2,0,0]=4 713 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000185746 [0,1,1,0,0,0|2,0,0]=4 714 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000185746 [0,1,1,0,0,0|2,0,0]=4 715 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185746 [0,1,1,0,0,0|1,0,0]=3 716 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [0,1,1,0,0,0|1,0,1]=4 717 B13R1.2422 C=Cc1ccc(c(c1C=O)F)OC 271570a_100011290941_100010204294 [0,1,1,0,0,0|2,0,0]=4 718 B13R1.2422 C=Cc1ccc(c(c1C=O)O)OC 271570a_100011290941_100009813834 [0,1,1,0,0,0|1,0,0]=3 719 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [1,1,0,0,0,0|2,0,0]=4 720 B13R2.57 C=Cc1ccc2ccccc2c1 271570a_100011290941_100000233703 [1,1,0,0,0,0|1,0,0]=3 721 B13R2.57 C=Cc1ccc2ccccc2n1 271570a_100011290941_100011291633 [1,1,0,0,0,0|2,0,0]=4 722 B13R2.57 C=Cc1ccc2cccnc2c1 271570a_100011290941_100009816655 [1,1,0,0,0,0|2,0,0]=4 723 B13R2.57 C=Cc1ccc2ccncc2c1 271570a_100011290941_100000686496 [1,1,0,0,0,0|2,0,0]=4 724 B13R2.57 C=Cc1ccc2cnccc2c1 271570a_100011290941_100009816743 [1,1,0,0,0,0|2,0,0]=4 725 B13R2.57 C=Cc1ccc2ncccc2c1 271570a_100011290941_100000754243 [1,1,0,0,0,0|2,0,0]=4 726 B13R2.57 C=Cc1cnc2ccccc2c1 271570a_100011290941_100000737414 [1,1,0,0,0,0|2,0,0]=4 727 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [1,1,0,0,0,0|1,0,0]=3 728 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [1,1,0,0,0,0|1,0,0]=3 729 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [1,1,0,0,0,0|2,0,0]=4 730 B13R2.57 CNc1ccc2cccnc2c1 34a_100102887122_200000210301 [1,1,0,0,0,0|2,0,0]=4 731 B13R2.57 CNc1ccc2cnccc2c1 34a_100000039641_200000210301 [1,1,0,0,0,0|2,0,0]=4 732 B13R2.57 CNc1ccc2ncccc2c1 34a_100011198106_200000210301 [1,1,0,0,0,0|2,0,0]=4 733 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [1,1,0,0,0,0|0,0,0]=2 734 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [1,1,0,0,0,0|0,0,0]=2 735 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [1,1,0,0,0,0|1,0,0]=3 736 B13R2.57 COc1ccc2ccncc2c1 7a_100000752006_200000210301 [1,1,0,0,0,0|1,0,0]=3 737 B13R2.57 COc1ccc2cnccc2c1 34a_100000046372_200000210301 [1,1,0,0,0,0|1,0,0]=3 738 B13R2.57 COc1ccc2cnccc2c1 7a_100000046372_200000210301 [1,1,0,0,0,0|1,0,0]=3 739 B13R2.57 COc1ccc2ncccc2c1 34a_100011215586_200000210301 [1,1,0,0,0,0|1,0,0]=3 740 B13R2.57 COc1ccc2ncccc2c1 7a_100011215586_200000210301 [1,1,0,0,0,0|1,0,0]=3 741 B13R2.57 COc1ccc2nccnc2c1 34a_100000694412_200000210301 [1,1,0,0,0,0|2,0,0]=4 742 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [1,1,0,0,0,0|1,0,0]=3 743 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [1,1,0,0,0,0|1,0,0]=3 744 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [1,1,0,0,0,0|1,1,0]=4 745 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [1,1,0,0,0,0|1,1,0]=4 746 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [1,1,0,0,0,0|0,1,0]=3 747 B13R2.57 CSc1ccc2ccccc2n1 62a_100011291633_200000210301 [1,1,0,0,0,0|1,1,0]=4 748 B13R2.57 CSc1ccc2ccccc2n1 62a_200000210301_100011291633 [1,1,0,0,0,0|1,1,0]=4 749 B13R2.57 CSc1ccc2cccnc2c1 62a_200000210301_100009816655 [1,1,0,0,0,0|1,1,0]=4 750 B13R2.57 CSc1ccc2ccncc2c1 62a_100000686496_200000210301 [1,1,0,0,0,0|1,1,0]=4 751 B13R2.57 CSc1ccc2ccncc2c1 62a_200000210301_100000686496 [1,1,0,0,0,0|1,1,0]=4 752 B13R2.57 CSc1ccc2cnccc2c1 62a_100009816743_200000210301 [1,1,0,0,0,0|1,1,0]=4 753 B13R2.57 CSc1ccc2cnccc2c1 62a_200000210301_100009816743 [1,1,0,0,0,0|1,1,0]=4 754 B13R2.57 CSc1ccc2ncccc2c1 62a_100011215947_200000210301 [1,1,0,0,0,0|1,1,0]=4 755 B13R2.57 CSc1ccc2ncccc2c1 62a_200000210301_100011215947 [1,1,0,0,0,0|1,1,0]=4 756 B13R2.57 CSc1cnc2ccccc2c1 62a_200000210301_100000737414 [1,1,0,0,0,0|1,1,0]=4 757 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [1,1,0,0,0,0|1,0,0]=3 758 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [1,1,0,0,0,0|1,0,0]=3 759 B13R2.57 [13CH3]Nc1ccc2cccnc2c1 34a_100102887122_200025704644 [1,1,0,0,0,0|2,0,0]=4 760 B13R2.57 [13CH3]Nc1ccc2cnccc2c1 34a_100000039641_200025704644 [1,1,0,0,0,0|2,0,0]=4 761 B13R2.57 [13CH3]Nc1ccc2ncccc2c1 34a_100011198106_200025704644 [1,1,0,0,0,0|2,0,0]=4 762 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [1,1,0,0,0,0|0,0,0]=2 763 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [1,1,0,0,0,0|0,0,0]=2 764 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [1,1,0,0,0,0|1,0,0]=3 765 B13R2.57 [13CH3]Oc1ccc2ccncc2c1 7a_100000752006_200025704644 [1,1,0,0,0,0|1,0,0]=3 766 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 34a_100000046372_200025704644 [1,1,0,0,0,0|1,0,0]=3 767 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 7a_100000046372_200025704644 [1,1,0,0,0,0|1,0,0]=3 768 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 34a_100011215586_200025704644 [1,1,0,0,0,0|1,0,0]=3 769 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 7a_100011215586_200025704644 [1,1,0,0,0,0|1,0,0]=3 770 B13R2.57 [13CH3]Oc1ccc2nccnc2c1 34a_100000694412_200025704644 [1,1,0,0,0,0|2,0,0]=4 771 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [1,1,0,0,0,0|1,0,0]=3 772 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [1,1,0,0,0,0|1,0,0]=3 773 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [1,1,0,0,0,0|1,1,0]=4 774 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [1,1,0,0,0,0|1,1,0]=4 775 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [1,1,0,0,0,0|0,1,0]=3 776 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_100011291633_200025704644 [1,1,0,0,0,0|1,1,0]=4 777 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_200025704644_100011291633 [1,1,0,0,0,0|1,1,0]=4 778 B13R2.57 [13CH3]Sc1ccc2cccnc2c1 62a_200025704644_100009816655 [1,1,0,0,0,0|1,1,0]=4 779 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_100000686496_200025704644 [1,1,0,0,0,0|1,1,0]=4 780 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_200025704644_100000686496 [1,1,0,0,0,0|1,1,0]=4 781 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_100009816743_200025704644 [1,1,0,0,0,0|1,1,0]=4 782 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_200025704644_100009816743 [1,1,0,0,0,0|1,1,0]=4 783 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_100011215947_200025704644 [1,1,0,0,0,0|1,1,0]=4 784 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_200025704644_100011215947 [1,1,0,0,0,0|1,1,0]=4 785 B13R2.57 [13CH3]Sc1cnc2ccccc2c1 62a_200025704644_100000737414 [1,1,0,0,0,0|1,1,0]=4 786 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [1,1,0,0,0,0|1,0,0]=3 787 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [1,1,0,0,0,0|1,0,0]=3 788 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [1,1,0,0,0,0|1,0,0]=3 789 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [1,1,0,0,0,0|2,0,0]=4 790 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [1,1,0,0,0,0|1,0,0]=3 791 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [1,1,0,0,0,0|0,0,0]=2 792 B13R2.155 Nc1ccc2ccc(cc2n1)O 271570a_203496583355_100010187616 [1,1,0,0,0,0|1,0,0]=3 793 B13R2.155 Nc1ccc2ccc(nc2n1)O 271570a_203496583355_100000117679 [1,1,0,0,0,0|2,0,0]=4 794 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [1,1,0,0,0,0|1,0,0]=3 795 B13R2.155 Nc1cnc2ccc(cc2n1)O 271570a_203496583355_100010090528 [1,1,0,0,0,0|2,0,0]=4 796 B13R2.155 Nc1ncc2ccc(cc2n1)O 271570a_203496583355_100010199760 [1,1,0,0,0,0|2,0,0]=4 797 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [1,1,0,0,0,0|1,0,0]=3 798 B13R2.155 O=c1ccc2cnc(cc2[nH]1)O 271570a_203496583355_100010563892 [1,1,0,0,0,0|2,0,0]=4 799 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [1,1,0,0,0,0|1,0,0]=3 800 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [1,1,0,0,0,0|0,0,0]=2 801 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [1,1,0,0,0,0|1,0,0]=3 802 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [1,1,0,0,0,0|1,0,0]=3 803 B13R2.155 Oc1ccc2ccc(nc2n1)O 271570a_203496583355_200010218124 [1,1,0,0,0,0|2,0,0]=4 804 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [1,1,0,0,0,0|1,0,0]=3 805 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [1,1,0,0,0,0|1,0,0]=3 806 B13R2.155 Oc1ccc2ncc(cc2c1)Br 271570a_203496583355_200010254249 [1,1,0,0,0,0|1,0,0]=3 807 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [1,1,0,0,0,0|1,0,0]=3 808 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [1,1,0,0,0,0|1,0,0]=3 809 B13R2.155 Oc1ccc2ncc(cc2n1)F 271570a_203496583355_100009889179 [1,1,0,0,0,0|2,0,0]=4 810 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [1,1,0,0,0,0|2,0,0]=4 811 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [1,1,0,0,0,0|2,0,0]=4 812 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [1,1,0,0,0,0|1,0,0]=3 813 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [1,1,0,0,0,0|1,0,0]=3 814 B13R2.155 Oc1cnc2ccc(nc2c1)O 271570a_203496583355_100010009477 [1,1,0,0,0,0|2,0,0]=4 815 B13R2.155 Oc1ncc2ccc(cc2n1)F 271570a_203496583355_100000104070 [1,1,0,0,0,0|2,0,0]=4 816 B13R2.155 [O-][n+]1ccc2ccc(cc2c1)O 271570a_203496583355_100009816120 [1,1,0,0,0,0|1,0,0]=3 817 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [1,1,0,0,0,0|2,0,0]=4 818 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [1,1,0,0,0,0|2,0,0]=4 819 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [1,1,0,0,0,0|2,0,0]=4 820 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [1,1,0,0,0,0|0,0,0]=2 821 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [1,1,0,0,0,0|1,0,0]=3 822 B13R2.162 Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100009817033 [1,1,0,0,0,0|1,0,0]=3 823 B13R2.162 Cc1nccc2c1cc(cc2)O 271570a_203496583355_200010739692 [1,1,0,0,0,0|1,0,0]=3 824 B13R2.162 Cc1ncnc2c1cc(cc2)O 271570a_203496583355_100000700471 [1,1,0,0,0,0|2,0,0]=4 825 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [1,1,0,0,0,0|2,0,0]=4 826 B13R2.162 Nc1ccc2nccc(c2c1)O 271570a_203496583355_100009879071 [1,1,0,0,0,0|2,0,0]=4 827 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [1,1,0,0,0,0|0,0,0]=2 828 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [1,1,0,0,0,0|1,0,0]=3 829 B13R2.162 Nc1ccnc2c1cc(cc2)O 271570a_203496583355_100011620571 [1,1,0,0,0,0|1,0,0]=3 830 B13R2.162 Nc1nccc2c1cc(cc2)O 271570a_203496583355_100012352255 [1,1,0,0,0,0|1,0,0]=3 831 B13R2.162 Nc1ncnc2c1cc(cc2)O 271570a_203496583355_100011390335 [1,1,0,0,0,0|2,0,0]=4 832 B13R2.162 O=c1[nH]ccc2c1cc(cn2)O 271570a_203496583355_100010134370 [1,1,0,0,0,0|2,0,0]=4 833 B13R2.162 O=c1[nH]cnc2c1cc(cc2)O 271570a_203496583355_100000755678 [1,1,0,0,0,0|2,0,0]=4 834 B13R2.162 O=c1[nH]ncc2c1cc(cc2)O 271570a_203496583355_100015864262 [1,1,0,0,0,0|2,0,0]=4 835 B13R2.162 O=c1cc[nH]c2c1cc(cc2)O 271570a_203496583355_100000746092 [1,1,0,0,0,0|1,0,0]=3 836 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [1,1,0,0,0,0|1,0,1]=4 837 B13R2.162 O=c1ccnc2n1cc(cc2)O 271570a_203496583355_100010178973 [1,1,0,0,0,0|2,0,0]=4 838 B13R2.162 O=c1ccoc2c1cc(cc2)O 271570a_203496583355_100009813387 [1,1,0,0,0,0|1,0,0]=3 839 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [1,1,0,0,0,0|0,0,0]=2 840 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [1,1,0,0,0,0|0,0,0]=2 841 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [1,1,0,0,0,0|1,0,0]=3 842 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [1,1,0,0,0,0|1,0,0]=3 843 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_100000010956 [1,1,0,0,0,0|1,0,0]=3 844 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_200009844553 [1,1,0,0,0,0|1,0,0]=3 845 B13R2.162 Oc1ccc2cncc(c2c1)O 271570a_203496583355_100010136424 [1,1,0,0,0,0|1,0,0]=3 846 B13R2.162 Oc1ccc2cncc(c2n1)O 271570a_203496583355_100009812673 [1,1,0,0,0,0|2,0,0]=4 847 B13R2.162 Oc1ccc2nccc(c2c1)Cl 271570a_203496583355_100011310491 [1,1,0,0,0,0|1,0,0]=3 848 B13R2.162 Oc1ccc2nccc(c2c1)O 271570a_203496583355_100000075933 [1,1,0,0,0,0|1,0,0]=3 849 B13R2.162 Oc1ccc2ncnc(c2c1)Cl 271570a_203496583355_100000757566 [1,1,0,0,0,0|2,0,0]=4 850 B13R2.162 Oc1ccc2nncc(c2c1)O 271570a_203496583355_100010074700 [1,1,0,0,0,0|2,0,0]=4 851 B13R2.162 Oc1ccnc2c1cc(cc2)Br 271570a_203496583355_100010189052 [1,1,0,0,0,0|2,0,0]=4 852 B13R2.162 Oc1ccnc2c1cc(cc2)F 271570a_203496583355_100011217270 [1,1,0,0,0,0|2,0,0]=4 853 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [1,1,0,0,0,0|1,0,0]=3 854 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [1,1,0,0,0,0|2,0,0]=4 855 B13R2.162 Oc1nccc2c1cc(cc2)F 271570a_203496583355_100010202866 [1,1,0,0,0,0|2,0,0]=4 856 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [1,1,0,0,0,0|2,0,0]=4 857 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [1,1,0,0,0,0|2,0,0]=4 858 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [1,1,0,0,0,0|1,0,0]=3 859 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [1,1,0,0,0,0|2,0,0]=4 860 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [1,1,0,0,0,0|1,0,0]=3 861 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [1,1,0,0,0,0|2,0,0]=4 862 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [1,1,0,0,0,0|2,0,0]=4 863 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [1,1,0,0,0,0|1,0,0]=3 864 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [1,1,0,0,0,0|0,0,0]=2 865 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [1,1,0,0,0,0|1,0,0]=3 866 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [1,1,0,0,0,0|1,0,0]=3 867 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [1,1,0,0,0,0|1,0,0]=3 868 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [1,1,0,0,0,0|2,0,0]=4 869 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [1,1,0,0,0,0|1,0,0]=3 870 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [1,1,0,0,0,0|1,0,0]=3 871 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [1,1,0,0,0,0|1,0,1]=4 872 B13R2.328 O=c1cc(nc2n1cccc2)O 271570a_203496583355_100000707704 [1,1,0,0,0,0|2,0,0]=4 873 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [1,1,0,0,0,0|0,0,0]=2 874 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [1,1,0,0,0,0|0,0,0]=2 875 B13R2.328 Oc1cc(c2cnccc2c1)F 271570a_203496583355_100011068762 [1,1,0,0,0,0|1,0,0]=3 876 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [1,1,0,0,0,0|1,0,0]=3 877 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [1,1,0,0,0,0|1,0,0]=3 878 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [1,1,0,0,0,0|1,0,0]=3 879 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [1,1,0,0,0,0|1,0,0]=3 880 B13R2.328 Oc1cc(c2nccnc2c1)F 271570a_203496583355_100010079260 [1,1,0,0,0,0|2,0,0]=4 881 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [1,1,0,0,0,0|2,0,0]=4 882 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [1,1,0,0,0,0|2,0,0]=4 883 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [1,1,0,0,0,0|1,0,1]=4 884 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [1,1,0,0,0,0|1,0,0]=3 885 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [1,1,0,0,0,0|1,0,0]=3 886 B13R2.369 Cc1cc2cccnc2nc1O 271570a_203496583355_100009877248 [1,1,0,0,0,0|2,0,0]=4 887 B13R2.369 Cc1cc2ncccc2cc1O 271570a_203496583355_100010137429 [1,1,0,0,0,0|1,0,0]=3 888 B13R2.369 Cc1cc2nccnc2cc1O 271570a_203496583355_100010080479 [1,1,0,0,0,0|2,0,0]=4 889 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [1,1,0,0,0,0|2,0,0]=4 890 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [1,1,0,0,0,0|0,0,0]=2 891 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [1,1,0,0,0,0|1,0,0]=3 892 B13R2.369 Nc1nc2ccccc2nc1O 271570a_203496583355_100000009970 [1,1,0,0,0,0|2,0,0]=4 893 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [1,1,0,0,0,0|1,0,0]=3 894 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [1,1,0,0,0,0|0,0,0]=2 895 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [1,1,0,0,0,0|0,0,0]=2 896 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [1,1,0,0,0,0|0,0,0]=2 897 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [1,1,0,0,0,0|1,0,0]=3 898 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [1,1,0,0,0,0|1,0,0]=3 899 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [1,1,0,0,0,0|1,0,0]=3 900 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [1,1,0,0,0,0|1,0,0]=3 901 B13R2.369 Oc1cc2cccnc2cc1F 271570a_203496583355_100009854028 [1,1,0,0,0,0|1,0,0]=3 902 B13R2.369 Oc1cc2cccnc2cc1O 271570a_203496583355_200010153759 [1,1,0,0,0,0|1,0,0]=3 903 B13R2.369 Oc1cc2ccncc2cc1F 271570a_203496583355_100011105921 [1,1,0,0,0,0|1,0,0]=3 904 B13R2.369 Oc1cc2cnccc2cc1F 271570a_203496583355_100010244713 [1,1,0,0,0,0|1,0,0]=3 905 B13R2.369 Oc1cc2nccnc2cc1F 271570a_203496583355_100010080477 [1,1,0,0,0,0|2,0,0]=4 906 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [1,1,0,0,0,0|1,0,0]=3 907 B13R2.3683 C[n+]1ccc2cc(ccc2c1)O 271570a_203496583355_100015191232 [1,1,0,0,0,0|1,0,0]=3 908 B13R2.3683 Cc1ccc2cc(ccc2n1)O 271570a_203496583355_100000686635 [1,1,0,0,0,0|1,0,0]=3 909 B13R2.3683 Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100011865911 [1,1,0,0,0,0|1,0,0]=3 910 B13R2.3683 Cc1ccc2nc(ccc2n1)O 271570a_203496583355_200009884078 [1,1,0,0,0,0|2,0,0]=4 911 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [1,1,0,0,0,0|1,0,0]=3 912 B13R2.3683 Nc1cc2ccc(cc2cn1)O 271570a_203496583355_100010232990 [1,1,0,0,0,0|1,0,0]=3 913 B13R2.3683 Nc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185457 [1,1,0,0,0,0|0,0,0]=2 914 B13R2.3683 Nc1ccc2cc(ccc2n1)O 271570a_203496583355_100011934619 [1,1,0,0,0,0|1,0,0]=3 915 B13R2.3683 Nc1ccc2cc(cnc2c1)O 271570a_203496583355_200010264087 [1,1,0,0,0,0|1,0,0]=3 916 B13R2.3683 Nc1ccc2cc(cnc2n1)O 271570a_203496583355_100010214896 [1,1,0,0,0,0|2,0,0]=4 917 B13R2.3683 Nc1ccc2nc(cnc2c1)O 271570a_203496583355_100009885871 [1,1,0,0,0,0|2,0,0]=4 918 B13R2.3683 Nc1cnc2cc(ccc2c1)O 271570a_203496583355_100010142226 [1,1,0,0,0,0|1,0,0]=3 919 B13R2.3683 Nc1ncc2cc(ccc2n1)O 271570a_203496583355_100010138702 [1,1,0,0,0,0|2,0,0]=4 920 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [1,1,0,0,0,0|1,0,0]=3 921 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [1,1,0,0,0,0|1,0,0]=3 922 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [1,1,0,0,0,0|2,0,0]=4 923 B13R2.3683 Oc1ccc2cc(ccc2c1)Br 271570a_203496583355_100012344972 [1,1,0,0,0,0|0,0,0]=2 924 B13R2.3683 Oc1ccc2cc(ccc2c1)F 271570a_203496583355_100009817052 [1,1,0,0,0,0|0,0,0]=2 925 B13R2.3683 Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185455 [1,1,0,0,0,0|0,0,0]=2 926 B13R2.3683 Oc1ccc2cc(ccc2n1)F 271570a_203496583355_100011998705 [1,1,0,0,0,0|1,0,0]=3 927 B13R2.3683 Oc1ccc2cc(cnc2c1)Br 271570a_203496583355_200015509644 [1,1,0,0,0,0|1,0,0]=3 928 B13R2.3683 Oc1ccc2cc(cnc2c1)F 271570a_203496583355_100010751466 [1,1,0,0,0,0|1,0,0]=3 929 B13R2.3683 Oc1ccc2nc(ccc2c1)Cl 271570a_203496583355_200012034268 [1,1,0,0,0,0|1,0,0]=3 930 B13R2.3683 Oc1ccc2nc(ccc2c1)O 271570a_203496583355_100009849208 [1,1,0,0,0,0|1,0,0]=3 931 B13R2.3683 Oc1ccc2nc(cnc2c1)O 271570a_203496583355_200010664160 [1,1,0,0,0,0|2,0,0]=4 932 B13R2.3683 Oc1cnc2cc(ccc2c1)Cl 271570a_203496583355_100015716233 [1,1,0,0,0,0|1,0,0]=3 933 B13R2.3683 Oc1cnc2cc(ccc2c1)O 271570a_203496583355_200010153753 [1,1,0,0,0,0|1,0,0]=3 934 B13R2.3683 Oc1cnc2cc(ccc2n1)F 271570a_203496583355_100000098432 [1,1,0,0,0,0|2,0,0]=4 935 B13R2.3683 Oc1cnc2nc(ccc2c1)O 271570a_203496583355_100009814606 [1,1,0,0,0,0|2,0,0]=4 936 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [1,1,0,0,0,0|2,0,0]=4 937 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [1,1,0,0,0,0|2,0,0]=4 938 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [1,1,0,0,0,0|1,0,0]=3 939 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [1,1,0,0,0,0|1,0,0]=3 940 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [1,1,0,0,0,0|2,0,0]=4 941 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [1,1,0,0,0,0|2,0,0]=4 942 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [1,1,0,0,0,0|0,0,0]=2 943 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [1,1,0,0,0,0|1,0,0]=3 944 B13R2.5179 Nc1ccnc2c1ccc(c2)O 271570a_203496583355_200009816820 [1,1,0,0,0,0|1,0,0]=3 945 B13R2.5179 Nc1nccc2c1ccc(c2)O 271570a_203496583355_100000732483 [1,1,0,0,0,0|1,0,0]=3 946 B13R2.5179 Nc1ncnc2c1ccc(c2)O 271570a_203496583355_100010199758 [1,1,0,0,0,0|2,0,0]=4 947 B13R2.5179 O=c1[nH]cnc2c1ccc(c2)O 271570a_203496583355_100000230960 [1,1,0,0,0,0|2,0,0]=4 948 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [1,1,0,0,0,0|1,0,1]=4 949 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [1,1,0,0,0,0|1,0,0]=3 950 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [1,1,0,0,0,0|1,0,0]=3 951 B13R2.5179 Oc1cc2ccnc(c2cn1)O 271570a_203496583355_100020669822 [1,1,0,0,0,0|2,0,0]=4 952 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [1,1,0,0,0,0|0,0,0]=2 953 B13R2.5179 Oc1ccc2c(ccnc2c1)Cl 271570a_203496583355_100009996786 [1,1,0,0,0,0|1,0,0]=3 954 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045489 [1,1,0,0,0,0|1,0,0]=3 955 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000756855 [1,1,0,0,0,0|1,0,0]=3 956 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100000760485 [1,1,0,0,0,0|1,0,0]=3 957 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100009867704 [1,1,0,0,0,0|1,0,0]=3 958 B13R2.5179 Oc1ccc2c(nncc2c1)O 271570a_203496583355_100000724280 [1,1,0,0,0,0|2,0,0]=4 959 B13R2.5179 Oc1ccnc2c1ccc(c2)Cl 271570a_203496583355_100012352046 [1,1,0,0,0,0|2,0,0]=4 960 B13R2.5179 Oc1ccnc2c1ccc(c2)F 271570a_203496583355_100000755548 [1,1,0,0,0,0|2,0,0]=4 961 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [1,1,0,0,0,0|1,0,0]=3 962 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [1,1,0,0,0,0|1,0,0]=3 963 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [1,1,0,0,0,0|1,0,0]=3 964 B13R2.5179 Oc1cnc2c(nccc2c1)O 271570a_203496583355_100010117065 [1,1,0,0,0,0|2,0,0]=4 965 B13R2.5179 Oc1nccc2c1ccc(c2)F 271570a_203496583355_100000097391 [1,1,0,0,0,0|2,0,0]=4 966 B13R2.5179 [O-][n+]1ccc2c(cccc2c1)O 271570a_203496583355_200010126733 [1,1,0,0,0,0|1,0,1]=4 967 B13R2.342 Cc1cccc2c1ccnc2O 271570a_203496583355_100012002547 [1,1,0,0,0,0|1,0,0]=3 968 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [1,1,0,0,0,0|1,0,0]=3 969 B13R2.342 Cc1cccc2c1ncnc2O 271570a_203496583355_100000751292 [1,1,0,0,0,0|2,0,0]=4 970 B13R2.342 Cc1ccnc2c1cccc2O 271570a_203496583355_100010254272 [1,1,0,0,0,0|1,0,0]=3 971 B13R2.342 Cc1ccnc2c1nccc2O 271570a_203496583355_200013369187 [1,1,0,0,0,0|2,0,0]=4 972 B13R2.342 Cc1nccc2c1cccc2O 271570a_203496583355_100010137443 [1,1,0,0,0,0|1,0,0]=3 973 B13R2.342 Nc1cccc2c1cccc2O 271570a_203496583355_100009816864 [1,1,0,0,0,0|0,0,0]=2 974 B13R2.342 Nc1cccc2c1ccnc2O 271570a_203496583355_100000070072 [1,1,0,0,0,0|1,0,0]=3 975 B13R2.342 Nc1cccc2c1nccc2O 271570a_203496583355_100009892510 [1,1,0,0,0,0|1,0,0]=3 976 B13R2.342 Nc1ccnc2c1cccc2O 271570a_203496583355_100011620713 [1,1,0,0,0,0|1,0,0]=3 977 B13R2.342 Nc1nccc2c1cccc2O 271570a_203496583355_103549770558 [1,1,0,0,0,0|1,0,0]=3 978 B13R2.342 Nc1ncnc2c1cccc2O 271570a_203496583355_100010199759 [1,1,0,0,0,0|2,0,0]=4 979 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [1,1,0,0,0,0|1,0,0]=3 980 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [1,1,0,0,0,0|1,0,0]=3 981 B13R2.342 Oc1cccc2c1cccc2F 271570a_203496583355_100009817034 [1,1,0,0,0,0|0,0,0]=2 982 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [1,1,0,0,0,0|0,0,0]=2 983 B13R2.342 Oc1cccc2c1ccnc2Cl 271570a_203496583355_100010080171 [1,1,0,0,0,0|1,0,0]=3 984 B13R2.342 Oc1ccnc2c1cccc2F 271570a_203496583355_100011934723 [1,1,0,0,0,0|1,0,0]=3 985 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [1,1,0,0,0,0|1,0,0]=3 986 B13R2.342 Oc1cncc2c1cccc2F 271570a_203496583355_100010740057 [1,1,0,0,0,0|1,0,0]=3 987 B13R2.342 Oc1nccc2c1cccc2F 271570a_203496583355_100012180906 [1,1,0,0,0,0|1,0,0]=3 988 B13R2.342 Oc1ncnc2c1cccc2F 271570a_203496583355_100000693626 [1,1,0,0,0,0|2,0,0]=4 989 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [1,1,0,0,0,0|2,0,0]=4 990 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [1,1,0,0,0,0|0,0,0]=2 991 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [1,1,0,0,0,0|1,0,0]=3 992 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [1,1,0,0,0,0|1,0,0]=3 993 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [1,1,0,0,0,0|1,0,0]=3 994 B13R2.371 Cc1nnc(c2c1cccc2)O 271570a_203496583355_100000189618 [1,1,0,0,0,0|2,0,0]=4 995 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [1,1,0,0,0,0|0,0,0]=2 996 B13R2.371 Nc1ccc(c2c1cccn2)O 271570a_203496583355_100012360041 [1,1,0,0,0,0|1,0,0]=3 997 B13R2.371 Nc1ccc(c2c1ccnc2)O 271570a_203496583355_200012344021 [1,1,0,0,0,0|1,0,0]=3 998 B13R2.371 Nc1ccc(c2c1cncc2)O 271570a_203496583355_100011218454 [1,1,0,0,0,0|1,0,0]=3 999 B13R2.371 Nc1ccc(c2c1nccc2)O 271570a_203496583355_100000726955 [1,1,0,0,0,0|1,0,0]=3 1000 B13R2.371 Nc1cnc(c2c1cccc2)O 271570a_203496583355_200009868590 [1,1,0,0,0,0|1,0,0]=3 1001 B13R2.371 Nc1ncc(c2c1cccc2)O 271570a_203496583355_100010158575 [1,1,0,0,0,0|1,0,0]=3 1002 B13R2.371 Nc1ncc(c2c1cccn2)O 271570a_203496583355_100010383929 [1,1,0,0,0,0|2,0,0]=4 1003 B13R2.371 O=c1[nH]cc(c2c1cncc2)O 271570a_203496583355_100010090797 [1,1,0,0,0,0|2,0,0]=4 1004 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [1,1,0,0,0,0|2,0,0]=4 1005 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [1,1,0,0,0,0|0,0,0]=2 1006 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [1,1,0,0,0,0|0,0,0]=2 1007 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [1,1,0,0,0,0|0,0,0]=2 1008 B13R2.371 Oc1ccc(c2c1cccn2)F 271570a_203496583355_100010245834 [1,1,0,0,0,0|1,0,0]=3 1009 B13R2.371 Oc1ccc(c2c1cccn2)O 271570a_203496583355_100011934063 [1,1,0,0,0,0|1,0,0]=3 1010 B13R2.371 Oc1ccc(c2c1ccnc2)F 271570a_203496583355_100000698020 [1,1,0,0,0,0|1,0,0]=3 1011 B13R2.371 Oc1ccc(c2c1cncc2)F 271570a_203496583355_100010244717 [1,1,0,0,0,0|1,0,0]=3 1012 B13R2.371 Oc1ccc(c2c1nccc2)F 271570a_203496583355_100010214461 [1,1,0,0,0,0|1,0,0]=3 1013 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100000067196 [1,1,0,0,0,0|1,0,0]=3 1014 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100009816523 [1,1,0,0,0,0|1,0,0]=3 1015 B13R2.371 [O-][n+]1ccc(c2c1cccc2)O 271570a_203496583355_100020656173 [1,1,0,0,0,0|1,0,0]=3 1016 B13R2.1613 C=Cc1cccc2c1cccc2 271570a_100011290941_100000210605 [1,1,0,0,0,0|1,0,0]=3 1017 B13R2.1613 C=Cc1cccc2c1cccn2 271570a_100011290941_100011290932 [1,1,0,0,0,0|2,0,0]=4 1018 B13R2.1613 C=Cc1cccc2c1ccnc2 271570a_100011290941_100000186358 [1,1,0,0,0,0|2,0,0]=4 1019 B13R2.1613 C=Cc1cccc2c1cncc2 271570a_100011290941_100000685578 [1,1,0,0,0,0|2,0,0]=4 1020 B13R2.1613 C=Cc1cccc2c1nccc2 271570a_100011290941_100011215545 [1,1,0,0,0,0|2,0,0]=4 1021 B13R2.1613 C=Cc1ccnc2c1cccc2 271570a_100011290941_100011215880 [1,1,0,0,0,0|2,0,0]=4 1022 B13R2.1613 C=Cc1cncc2c1cccc2 271570a_100011290941_100000187577 [1,1,0,0,0,0|2,0,0]=4 1023 B13R2.1613 C=Cc1nccc2c1cccc2 271570a_100011290941_100011934041 [1,1,0,0,0,0|2,0,0]=4 1024 B13R2.1613 CNc1cccc2c1cccc2 34a_100000185869_200000210301 [1,1,0,0,0,0|1,0,0]=3 1025 B13R2.1613 CNc1cccc2c1cccn2 27a_100102657272_100011290932 [1,1,0,0,0,0|2,0,0]=4 1026 B13R2.1613 CNc1cccc2c1cccn2 34a_100000183906_200000210301 [1,1,0,0,0,0|2,0,0]=4 1027 B13R2.1613 CNc1cccc2c1nccc2 34a_100000181377_200000210301 [1,1,0,0,0,0|2,0,0]=4 1028 B13R2.1613 CNc1ccnc2c1cccc2 27a_100102657272_100011215880 [1,1,0,0,0,0|2,0,0]=4 1029 B13R2.1613 CNc1nccc2c1cccc2 27a_100102657272_100011934041 [1,1,0,0,0,0|2,0,0]=4 1030 B13R2.1613 COc1cccc2c1CC=CC2 34a_100000074931_200000210301 [1,1,0,0,0,0|0,0,2]=4 1031 B13R2.1613 COc1cccc2c1CC=CC2 7a_100000074931_200000210301 [1,1,0,0,0,0|0,0,2]=4 1032 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [1,1,0,0,0,0|0,0,0]=2 1033 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [1,1,0,0,0,0|0,0,0]=2 1034 B13R2.1613 COc1cccc2c1cccn2 34a_100011197808_200000210301 [1,1,0,0,0,0|1,0,0]=3 1035 B13R2.1613 COc1cccc2c1ccnc2 34a_100011218533_200000210301 [1,1,0,0,0,0|1,0,0]=3 1036 B13R2.1613 COc1cccc2c1cncc2 34a_103624766955_200000210301 [1,1,0,0,0,0|1,0,0]=3 1037 B13R2.1613 COc1cccc2c1nccc2 34a_100000056035_200000210301 [1,1,0,0,0,0|1,0,0]=3 1038 B13R2.1613 COc1cccc2c1nccn2 34a_100000077048_200000210301 [1,1,0,0,0,0|2,0,0]=4 1039 B13R2.1613 COc1cccc2c1ncnc2 34a_200000077003_200000210301 [1,1,0,0,0,0|2,0,0]=4 1040 B13R2.1613 COc1cncc2c1cccc2 34a_100000066178_200000210301 [1,1,0,0,0,0|1,0,0]=3 1041 B13R2.1613 COc1cncc2c1cccc2 7a_100000066178_200000210301 [1,1,0,0,0,0|1,0,0]=3 1042 B13R2.1613 COc1nccc2c1cccc2 34a_102531767632_200000210301 [1,1,0,0,0,0|1,0,0]=3 1043 B13R2.1613 CSc1cccc2c1cccc2 62a_200000210301_100000210605 [1,1,0,0,0,0|0,1,0]=3 1044 B13R2.1613 CSc1cccc2c1cccn2 62a_100011290932_200000210301 [1,1,0,0,0,0|1,1,0]=4 1045 B13R2.1613 CSc1cccc2c1cccn2 62a_200000210301_100011290932 [1,1,0,0,0,0|1,1,0]=4 1046 B13R2.1613 CSc1cccc2c1ccnc2 62a_100000186358_200000210301 [1,1,0,0,0,0|1,1,0]=4 1047 B13R2.1613 CSc1cccc2c1ccnc2 62a_200000210301_100000186358 [1,1,0,0,0,0|1,1,0]=4 1048 B13R2.1613 CSc1cccc2c1cncc2 62a_100000685578_200000210301 [1,1,0,0,0,0|1,1,0]=4 1049 B13R2.1613 CSc1cccc2c1cncc2 62a_200000210301_100000685578 [1,1,0,0,0,0|1,1,0]=4 1050 B13R2.1613 CSc1cccc2c1nccc2 62a_200000210301_100011215545 [1,1,0,0,0,0|1,1,0]=4 1051 B13R2.1613 CSc1ccnc2c1cccc2 62a_100011458314_200000210301 [1,1,0,0,0,0|1,1,0]=4 1052 B13R2.1613 CSc1ccnc2c1cccc2 62a_200000210301_100011215880 [1,1,0,0,0,0|1,1,0]=4 1053 B13R2.1613 CSc1cncc2c1cccc2 62a_100000187577_200000210301 [1,1,0,0,0,0|1,1,0]=4 1054 B13R2.1613 CSc1cncc2c1cccc2 62a_200000210301_100000187577 [1,1,0,0,0,0|1,1,0]=4 1055 B13R2.1613 CSc1nccc2c1cccc2 62a_100011934041_200000210301 [1,1,0,0,0,0|1,1,0]=4 1056 B13R2.1613 CSc1nccc2c1cccc2 62a_200000210301_100011934041 [1,1,0,0,0,0|1,1,0]=4 1057 B13R2.1613 [13CH3]Nc1cccc2c1cccc2 34a_100000185869_200025704644 [1,1,0,0,0,0|1,0,0]=3 1058 B13R2.1613 [13CH3]Nc1cccc2c1cccn2 34a_100000183906_200025704644 [1,1,0,0,0,0|2,0,0]=4 1059 B13R2.1613 [13CH3]Nc1cccc2c1nccc2 34a_100000181377_200025704644 [1,1,0,0,0,0|2,0,0]=4 1060 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 34a_100000074931_200025704644 [1,1,0,0,0,0|0,0,2]=4 1061 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 7a_100000074931_200025704644 [1,1,0,0,0,0|0,0,2]=4 1062 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [1,1,0,0,0,0|0,0,0]=2 1063 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [1,1,0,0,0,0|0,0,0]=2 1064 B13R2.1613 [13CH3]Oc1cccc2c1cccn2 34a_100011197808_200025704644 [1,1,0,0,0,0|1,0,0]=3 1065 B13R2.1613 [13CH3]Oc1cccc2c1ccnc2 34a_100011218533_200025704644 [1,1,0,0,0,0|1,0,0]=3 1066 B13R2.1613 [13CH3]Oc1cccc2c1cncc2 34a_103624766955_200025704644 [1,1,0,0,0,0|1,0,0]=3 1067 B13R2.1613 [13CH3]Oc1cccc2c1nccc2 34a_100000056035_200025704644 [1,1,0,0,0,0|1,0,0]=3 1068 B13R2.1613 [13CH3]Oc1cccc2c1nccn2 34a_100000077048_200025704644 [1,1,0,0,0,0|2,0,0]=4 1069 B13R2.1613 [13CH3]Oc1cccc2c1ncnc2 34a_200000077003_200025704644 [1,1,0,0,0,0|2,0,0]=4 1070 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 34a_100000066178_200025704644 [1,1,0,0,0,0|1,0,0]=3 1071 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 7a_100000066178_200025704644 [1,1,0,0,0,0|1,0,0]=3 1072 B13R2.1613 [13CH3]Oc1nccc2c1cccc2 34a_102531767632_200025704644 [1,1,0,0,0,0|1,0,0]=3 1073 B13R2.1613 [13CH3]Sc1cccc2c1cccc2 62a_200025704644_100000210605 [1,1,0,0,0,0|0,1,0]=3 1074 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_100011290932_200025704644 [1,1,0,0,0,0|1,1,0]=4 1075 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_200025704644_100011290932 [1,1,0,0,0,0|1,1,0]=4 1076 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_100000186358_200025704644 [1,1,0,0,0,0|1,1,0]=4 1077 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_200025704644_100000186358 [1,1,0,0,0,0|1,1,0]=4 1078 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_100000685578_200025704644 [1,1,0,0,0,0|1,1,0]=4 1079 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_200025704644_100000685578 [1,1,0,0,0,0|1,1,0]=4 1080 B13R2.1613 [13CH3]Sc1cccc2c1nccc2 62a_200025704644_100011215545 [1,1,0,0,0,0|1,1,0]=4 1081 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_100011458314_200025704644 [1,1,0,0,0,0|1,1,0]=4 1082 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_200025704644_100011215880 [1,1,0,0,0,0|1,1,0]=4 1083 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_100000187577_200025704644 [1,1,0,0,0,0|1,1,0]=4 1084 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_200025704644_100000187577 [1,1,0,0,0,0|1,1,0]=4 1085 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_100011934041_200025704644 [1,1,0,0,0,0|1,1,0]=4 1086 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_200025704644_100011934041 [1,1,0,0,0,0|1,1,0]=4 1087 B13R2.4818 Cc1cccc2c1c(ccc2)O 271570a_203496583355_100009995290 [1,1,0,0,0,0|0,0,0]=2 1088 B13R2.4818 Cc1cncc2c1c(ccc2)O 271570a_203496583355_100009817140 [1,1,0,0,0,0|1,0,0]=3 1089 B13R2.4818 Nc1cccc2c1c(ccc2)O 271570a_203496583355_100010002837 [1,1,0,0,0,0|0,0,0]=2 1090 B13R2.4818 Nc1cccc2c1c(ccn2)O 271570a_203496583355_100010263589 [1,1,0,0,0,0|1,0,0]=3 1091 B13R2.4818 Nc1cccc2c1c(cnc2)O 271570a_203496583355_100000720362 [1,1,0,0,0,0|1,0,0]=3 1092 B13R2.4818 Nc1nccc2c1c(ccc2)O 271570a_203496583355_100010291105 [1,1,0,0,0,0|1,0,0]=3 1093 B13R2.4818 Nc1ncnc2c1c(ccc2)O 271570a_203496583355_100010171649 [1,1,0,0,0,0|2,0,0]=4 1094 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [1,1,0,0,0,0|2,0,0]=4 1095 B13R2.4818 Oc1cccc2c1c(ccc2)Br 271570a_203496583355_100010243825 [1,1,0,0,0,0|0,0,0]=2 1096 B13R2.4818 Oc1cccc2c1c(ccc2)F 271570a_203496583355_100010177852 [1,1,0,0,0,0|0,0,0]=2 1097 B13R2.4818 Oc1cccc2c1c(ccc2)O 271570a_203496583355_100010089961 [1,1,0,0,0,0|0,0,0]=2 1098 B13R2.4818 Oc1cccc2c1c(ccn2)O 271570a_203496583355_100010187735 [1,1,0,0,0,0|1,0,0]=3 1099 B13R2.4818 Oc1cccc2c1c(ncc2)O 271570a_203496583355_100010162479 [1,1,0,0,0,0|1,0,0]=3 1100 B13R2.4818 Oc1ncnc2c1c(ccc2)F 271570a_203496583355_100000743342 [1,1,0,0,0,0|2,0,0]=4 1101 B13R2.45 COc1cc2ccccc2n1C 34a_100000066695_200000210301 [0,1,0,0,1,0|2,0,0]=4 1102 B13R2.45 Cn1c(cc2c1cccc2)O[13CH3] 34a_100000066695_200025704644 [0,1,0,0,1,0|2,0,0]=4 1103 B13R2.45 O=Cc1sc2ccccc2c1O 271570a_203496583355_100009816528 [0,1,0,0,1,0|1,0,1]=4 1104 B13R2.84 COc1ccc2[nH]ccc2c1O 271570a_203496583355_100010169049 [0,1,0,0,1,0|1,0,0]=3 1105 B13R2.84 COc1ccc2[nH]ncc2c1O 271570a_203496583355_100010125576 [0,1,0,0,1,0|2,0,0]=4 1106 B13R2.84 COc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097410 [0,1,0,0,1,0|2,0,0]=4 1107 B13R2.84 COc1ncc2cc[nH]c2c1O 271570a_203496583355_100010168355 [0,1,0,0,1,0|2,0,0]=4 1108 B13R2.84 N#Cc1ccc2cc[nH]c2c1O 271570a_203496583355_103550291079 [0,1,0,0,1,0|2,0,0]=4 1109 B13R2.121 COc1c(ccc2c1cn[nH]2)O 271570a_203496583355_100009817061 [0,1,0,0,1,0|2,0,0]=4 1110 B13R2.121 COc1c(cnc2c1cc[nH]2)O 271570a_203496583355_100010174914 [0,1,0,0,1,0|2,0,0]=4 1111 B13R2.5393 Cc1cc(c2[nH]ccc2c1O)C 271570a_203496583355_100010244417 [0,1,0,0,1,0|2,0,0]=4 1112 B15R2.274 CSc1c(c2ccccc2oc1=O)O 62a_200000210301_100009994742 [0,2,0,0,0,0|1,1,0]=4 1113 B15R2.274 N#Cc1c(c2ccccc2[nH]c1=O)O 271570a_203496583355_100000040898 [0,2,0,0,0,0|2,0,0]=4 1114 B15R2.274 O=Cc1c(c2ccccc2oc1=O)O 271570a_203496583355_100000046281 [0,2,0,0,0,0|1,0,1]=4 1115 B15R2.274 [13CH3]Sc1c(c2ccccc2oc1=O)O 62a_200025704644_100009994742 [0,2,0,0,0,0|1,1,0]=4 1116 B15R2.627 C=C(C)c1ccc2ccccc2c1Br 271570a_100000694244_200010089984 [0,2,0,0,0,0|2,0,0]=4 1117 B15R2.627 C=C(C)c1ccc2ccccc2c1C 271570a_100000694244_100010221197 [0,2,0,0,0,0|2,0,0]=4 1118 B15R2.627 C=C(C)c1ccc2ccccc2c1F 271570a_100000694244_100009832041 [0,2,0,0,0,0|2,0,0]=4 1119 B15R2.627 C=C(C)c1ccc2ccccc2c1N 271570a_100000694244_100009817101 [0,2,0,0,0,0|2,0,0]=4 1120 B15R2.627 C=C(C)c1ccc2ccccc2c1O 271570a_100000694244_100009996032 [0,2,0,0,0,0|1,0,0]=3 1121 B15R2.627 C=C(C)c1ccc2cccnc2c1O 271570a_100000694244_100009816563 [0,2,0,0,0,0|2,0,0]=4 1122 B15R2.627 CC(=O)c1ccc2ccccc2c1Br 1458a_100000239384_200000210301 [0,2,0,0,0,0|1,0,1]=4 1123 B15R2.627 CC(=O)c1ccc2ccccc2c1O 1458a_100000181341_200000210301 [0,2,0,0,0,0|0,0,1]=3 1124 B15R2.627 CC(=O)c1ccc2cccnc2c1O 1458a_100000036822_200000210301 [0,2,0,0,0,0|1,0,1]=4 1125 B15R2.627 NC(=O)c1ccc2ccccc2c1O 271570a_203496583355_100011091912 [0,2,0,0,0,0|0,0,1]=3 1126 B15R2.627 [13CH3]C(=O)c1ccc2ccccc2c1Br 1458a_100000239384_200025704644 [0,2,0,0,0,0|1,0,1]=4 1127 B15R2.627 [13CH3]C(=O)c1ccc2ccccc2c1O 1458a_100000181341_200025704644 [0,2,0,0,0,0|0,0,1]=3 1128 B15R2.627 [13CH3]C(=O)c1ccc2cccnc2c1O 1458a_100000036822_200025704644 [0,2,0,0,0,0|1,0,1]=4 1129 B15R2.2115 C=Cc1c(ccc2c1cccc2)C=O 271570a_100011290941_100009813496 [0,2,0,0,0,0|1,0,1]=4 1130 B15R2.2115 C=Cc1c(ccc2c1cccc2)OC 271570a_100011290941_100000173347 [0,2,0,0,0,0|1,0,0]=3 1131 B15R2.2115 C=Cc1c(ccc2c1nccc2)OC 271570a_100011290941_100010071576 [0,2,0,0,0,0|2,0,0]=4 1132 B15R2.2115 C=Cc1ccc2ccccc2c1C=O 271570a_100011290941_100010090029 [0,2,0,0,0,0|1,0,1]=4 1133 B15R2.2115 C=Cc1ccc2ccccc2c1OC 271570a_100011290941_100010089960 [0,2,0,0,0,0|1,0,0]=3 1134 B15R2.2115 C=Cc1ccc2cccnc2c1OC 271570a_100011290941_100010256708 [0,2,0,0,0,0|2,0,0]=4 1135 B15R2.2115 CNc1c(ccc2c1cccc2)OC 34a_100009884440_200000210301 [0,2,0,0,0,0|1,0,0]=3 1136 B15R2.2115 CNc1ccc2ncccc2c1OC 34a_100009831023_200000210301 [0,2,0,0,0,0|2,0,0]=4 1137 B15R2.2115 COc1c(ccc2c1cccc2)N=O 34a_100000212301_200000210301 [0,2,0,0,0,0|0,0,1]=3 1138 B15R2.2115 COc1c(ccc2c1cccc2)SC 62a_200000210301_100010089960 [0,2,0,0,0,0|0,1,0]=3 1139 B15R2.2115 COc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010089960 [0,2,0,0,0,0|0,1,0]=3 1140 B15R2.2115 COc1c(ccc2c1cccn2)N[13CH3] 34a_100009831023_200025704644 [0,2,0,0,0,0|2,0,0]=4 1141 B15R2.2115 COc1c(ccc2c1nccc2)SC 62a_200000210301_100010256708 [0,2,0,0,0,0|1,1,0]=4 1142 B15R2.2115 COc1c(ccc2c1nccc2)S[13CH3] 62a_200025704644_100010256708 [0,2,0,0,0,0|1,1,0]=4 1143 B15R2.2115 COc1ccc2ccccc2c1N=O 34a_100000212102_200000210301 [0,2,0,0,0,0|0,0,1]=3 1144 B15R2.2115 COc1ccc2ccccc2c1N=O 7a_100000212102_200000210301 [0,2,0,0,0,0|0,0,1]=3 1145 B15R2.2115 COc1ccc2ccccc2c1N[13CH3] 34a_100009884440_200025704644 [0,2,0,0,0,0|1,0,0]=3 1146 B15R2.2115 COc1ccc2ccccc2c1SC 62a_200000210301_100000173347 [0,2,0,0,0,0|0,1,0]=3 1147 B15R2.2115 COc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000173347 [0,2,0,0,0,0|0,1,0]=3 1148 B15R2.2115 COc1ccc2cccnc2c1SC 62a_200000210301_100010071576 [0,2,0,0,0,0|1,1,0]=4 1149 B15R2.2115 COc1ccc2cccnc2c1S[13CH3] 62a_200025704644_100010071576 [0,2,0,0,0,0|1,1,0]=4 1150 B15R2.2115 COc1cnc2ccccc2c1C#N 7a_100009853984_200000210301 [0,2,0,0,0,0|2,0,0]=4 1151 B15R2.2115 CSc1c(ccc2c1cccc2)C=O 62a_100009813496_200000210301 [0,2,0,0,0,0|0,1,1]=4 1152 B15R2.2115 CSc1c(ccc2c1cccc2)C=O 62a_200000210301_100009813496 [0,2,0,0,0,0|0,1,1]=4 1153 B15R2.2115 CSc1ccc2ccccc2c1C=O 62a_100010090029_200000210301 [0,2,0,0,0,0|0,1,1]=4 1154 B15R2.2115 [13CH3]Oc1c(ccc2c1cccc2)N=O 34a_100000212301_200025704644 [0,2,0,0,0,0|0,0,1]=3 1155 B15R2.2115 [13CH3]Oc1ccc2ccccc2c1N=O 34a_100000212102_200025704644 [0,2,0,0,0,0|0,0,1]=3 1156 B15R2.2115 [13CH3]Oc1ccc2ccccc2c1N=O 7a_100000212102_200025704644 [0,2,0,0,0,0|0,0,1]=3 1157 B15R2.2115 [13CH3]Oc1cnc2ccccc2c1C#N 7a_100009853984_200025704644 [0,2,0,0,0,0|2,0,0]=4 1158 B15R2.2115 [13CH3]Sc1c(ccc2c1cccc2)C=O 62a_100009813496_200025704644 [0,2,0,0,0,0|0,1,1]=4 1159 B15R2.2115 [13CH3]Sc1c(ccc2c1cccc2)C=O 62a_200025704644_100009813496 [0,2,0,0,0,0|0,1,1]=4 1160 B15R2.2115 [13CH3]Sc1ccc2ccccc2c1C=O 62a_100010090029_200025704644 [0,2,0,0,0,0|0,1,1]=4 1161 B15R2.2220 C=C=Cc1ccc2ccccc2c1Br 271570a_100015277604_200010089984 [0,2,0,0,0,0|2,0,0]=4 1162 B15R2.2220 C=C=Cc1ccc2ccccc2c1C 271570a_100015277604_100010221197 [0,2,0,0,0,0|2,0,0]=4 1163 B15R2.2220 C=C=Cc1ccc2ccccc2c1F 271570a_100015277604_100009832041 [0,2,0,0,0,0|2,0,0]=4 1164 B15R2.2220 C=C=Cc1ccc2ccccc2c1N 271570a_100015277604_100009817101 [0,2,0,0,0,0|2,0,0]=4 1165 B15R2.2220 C=C=Cc1ccc2ccccc2c1O 271570a_100015277604_100009996032 [0,2,0,0,0,0|1,0,0]=3 1166 B15R2.2220 C=C=Cc1ccc2cccnc2c1O 271570a_100015277604_100009816563 [0,2,0,0,0,0|2,0,0]=4 1167 B15R2.2220 CC=Cc1ccc2ccccc2c1Br 271570a_100016259895_200010089984 [0,2,0,0,0,0|2,0,0]=4 1168 B15R2.2220 CC=Cc1ccc2ccccc2c1C 271570a_100016259895_100010221197 [0,2,0,0,0,0|2,0,0]=4 1169 B15R2.2220 CC=Cc1ccc2ccccc2c1F 271570a_100016259895_100009832041 [0,2,0,0,0,0|2,0,0]=4 1170 B15R2.2220 CC=Cc1ccc2ccccc2c1N 271570a_100016259895_100009817101 [0,2,0,0,0,0|2,0,0]=4 1171 B15R2.2220 CC=Cc1ccc2ccccc2c1O 271570a_100016259895_100009996032 [0,2,0,0,0,0|1,0,0]=3 1172 B15R2.2220 CC=Cc1ccc2cccnc2c1O 271570a_100016259895_100009816563 [0,2,0,0,0,0|2,0,0]=4 1173 B15R2.2220 CCNc1ccc2ccccc2c1Br 34a_100000705303_100000210202 [0,2,0,0,0,0|2,0,0]=4 1174 B15R2.2220 CCNc1ccc2ccccc2c1Cl 34a_100000075557_100000210202 [0,2,0,0,0,0|2,0,0]=4 1175 B15R2.2220 CCNc1ccc2ccccc2c1O 34a_100000007060_100000210202 [0,2,0,0,0,0|1,0,0]=3 1176 B15R2.2220 CCOc1ccc2ccccc2c1Br 34a_100000183829_100000210202 [0,2,0,0,0,0|1,0,0]=3 1177 B15R2.2220 CCOc1ccc2ccccc2c1Br 7a_100000183829_100000210202 [0,2,0,0,0,0|1,0,0]=3 1178 B15R2.2220 CCOc1ccc2ccccc2c1C 34a_100009830054_100000210202 [0,2,0,0,0,0|1,0,0]=3 1179 B15R2.2220 CCOc1ccc2ccccc2c1C 7a_100009830054_100000210202 [0,2,0,0,0,0|1,0,0]=3 1180 B15R2.2220 CCOc1ccc2ccccc2c1Cl 34a_100000029778_100000210202 [0,2,0,0,0,0|1,0,0]=3 1181 B15R2.2220 CCOc1ccc2ccccc2c1Cl 7a_100000029778_100000210202 [0,2,0,0,0,0|1,0,0]=3 1182 B15R2.2220 CCOc1ccc2ccccc2c1I 34a_100000041551_100000210202 [0,2,0,0,0,0|1,0,0]=3 1183 B15R2.2220 CCOc1ccc2ccccc2c1I 7a_100000041551_100000210202 [0,2,0,0,0,0|1,0,0]=3 1184 B15R2.2220 CCOc1ccc2ccccc2c1N 34a_100000007056_100000210202 [0,2,0,0,0,0|1,0,0]=3 1185 B15R2.2220 CCOc1ccc2ccccc2c1N 7a_100000007056_100000210202 [0,2,0,0,0,0|1,0,0]=3 1186 B15R2.2220 CCOc1ccc2ccccc2c1O 271570a_203496583355_200000173018 [0,2,0,0,0,0|0,0,0]=2 1187 B15R2.2220 CCOc1ccc2cccnc2c1Br 34a_100010173343_100000210202 [0,2,0,0,0,0|2,0,0]=4 1188 B15R2.2220 CCOc1ccc2cccnc2c1Br 7a_100010173343_100000210202 [0,2,0,0,0,0|2,0,0]=4 1189 B15R2.2220 CCOc1ccc2ccncc2c1Br 34a_200010115057_100000210202 [0,2,0,0,0,0|2,0,0]=4 1190 B15R2.2220 CCOc1ccc2ccncc2c1Br 7a_200010115057_100000210202 [0,2,0,0,0,0|2,0,0]=4 1191 B15R2.2220 CCOc1ccc2cnccc2c1Cl 34a_100009824633_100000210202 [0,2,0,0,0,0|2,0,0]=4 1192 B15R2.2220 CCOc1ccc2cnccc2c1Cl 7a_100009824633_100000210202 [0,2,0,0,0,0|2,0,0]=4 1193 B15R2.2220 CCSc1ccc2ccccc2c1Br 62a_100000210202_200010089984 [0,2,0,0,0,0|1,1,0]=4 1194 B15R2.2220 CCSc1ccc2ccccc2c1Br 62a_200010089984_100000210202 [0,2,0,0,0,0|1,1,0]=4 1195 B15R2.2220 CCSc1ccc2ccccc2c1C 62a_100000210202_100010221197 [0,2,0,0,0,0|1,1,0]=4 1196 B15R2.2220 CCSc1ccc2ccccc2c1C 62a_100010221197_100000210202 [0,2,0,0,0,0|1,1,0]=4 1197 B15R2.2220 CCSc1ccc2ccccc2c1F 62a_100000210202_100009832041 [0,2,0,0,0,0|1,1,0]=4 1198 B15R2.2220 CCSc1ccc2ccccc2c1F 62a_100009832041_100000210202 [0,2,0,0,0,0|1,1,0]=4 1199 B15R2.2220 CCSc1ccc2ccccc2c1N 62a_100009817101_100000210202 [0,2,0,0,0,0|1,1,0]=4 1200 B15R2.2220 CCSc1ccc2ccccc2c1O 62a_100000210202_100009996032 [0,2,0,0,0,0|0,1,0]=3 1201 B15R2.2220 CCSc1ccc2cccnc2c1O 62a_100000210202_100009816563 [0,2,0,0,0,0|1,1,0]=4 1202 B15R2.2220 CNCc1ccc2ccccc2c1Br 207a_100102657272_100009813496 [0,2,0,0,0,0|2,0,0]=4 1203 B15R2.2220 CNCc1ccc2ccccc2c1Br 2230a_106832991635_100009813938 [0,2,0,0,0,0|2,0,0]=4 1204 B15R2.2220 CNCc1ccc2ccccc2c1Br 26a_100102657272_100000183829 [0,2,0,0,0,0|2,0,0]=4 1205 B15R2.2220 CNCc1ccc2ccccc2c1Br 270004a_106832991635_100009813496 [0,2,0,0,0,0|2,0,0]=4 1206 B15R2.2220 CNCc1ccc2ccccc2c1Br 34a_100102657272_100009813938 [0,2,0,0,0,0|2,0,0]=4 1207 B15R2.2220 CNCc1ccc2ccccc2c1Br 7a_106832991635_100009813938 [0,2,0,0,0,0|2,0,0]=4 1208 B15R2.2220 COCc1ccc2ccccc2c1Br 34a_100138415774_100009813938 [0,2,0,0,0,0|1,0,0]=3 1209 B15R2.2220 COCc1ccc2ccccc2c1O 271570a_203496583355_200009813570 [0,2,0,0,0,0|0,0,0]=2 1210 B15R2.2220 CSCc1ccc2ccccc2c1Br 62a_100009813938_200000210301 [0,2,0,0,0,0|1,1,0]=4 1211 B15R2.2220 CSCc1ccc2ccccc2c1Br 62a_200000210301_100009813938 [0,2,0,0,0,0|1,1,0]=4 1212 B15R2.2220 Cc1c(ccc2c1cccc2)OCF 34a_100009830054_100015361967 [0,2,0,0,0,0|1,0,0]=3 1213 B15R2.2220 Cc1c(ccc2c1cccc2)OCF 7a_100009830054_100015361967 [0,2,0,0,0,0|1,0,0]=3 1214 B15R2.2220 Cc1c(ccc2c1cccc2)SCF 62a_100010221197_100015361967 [0,2,0,0,0,0|1,1,0]=4 1215 B15R2.2220 Cc1c(ccc2c1cccc2)SCF 62a_100015361967_100010221197 [0,2,0,0,0,0|1,1,0]=4 1216 B15R2.2220 FCNc1ccc2ccccc2c1Br 34a_100000705303_100015361967 [0,2,0,0,0,0|2,0,0]=4 1217 B15R2.2220 FCNc1ccc2ccccc2c1Cl 34a_100000075557_100015361967 [0,2,0,0,0,0|2,0,0]=4 1218 B15R2.2220 FCOc1ccc2ccccc2c1Br 34a_100000183829_100015361967 [0,2,0,0,0,0|1,0,0]=3 1219 B15R2.2220 FCOc1ccc2ccccc2c1Br 7a_100000183829_100015361967 [0,2,0,0,0,0|1,0,0]=3 1220 B15R2.2220 FCOc1ccc2ccccc2c1Cl 34a_100000029778_100015361967 [0,2,0,0,0,0|1,0,0]=3 1221 B15R2.2220 FCOc1ccc2ccccc2c1Cl 7a_100000029778_100015361967 [0,2,0,0,0,0|1,0,0]=3 1222 B15R2.2220 FCOc1ccc2ccccc2c1I 34a_100000041551_100015361967 [0,2,0,0,0,0|1,0,0]=3 1223 B15R2.2220 FCOc1ccc2ccccc2c1I 7a_100000041551_100015361967 [0,2,0,0,0,0|1,0,0]=3 1224 B15R2.2220 FCOc1ccc2cccnc2c1Br 34a_100010173343_100015361967 [0,2,0,0,0,0|2,0,0]=4 1225 B15R2.2220 FCOc1ccc2cccnc2c1Br 7a_100010173343_100015361967 [0,2,0,0,0,0|2,0,0]=4 1226 B15R2.2220 FCOc1ccc2ccncc2c1Br 34a_200010115057_100015361967 [0,2,0,0,0,0|2,0,0]=4 1227 B15R2.2220 FCOc1ccc2ccncc2c1Br 7a_200010115057_100015361967 [0,2,0,0,0,0|2,0,0]=4 1228 B15R2.2220 FCOc1ccc2cnccc2c1Cl 34a_100009824633_100015361967 [0,2,0,0,0,0|2,0,0]=4 1229 B15R2.2220 FCOc1ccc2cnccc2c1Cl 7a_100009824633_100015361967 [0,2,0,0,0,0|2,0,0]=4 1230 B15R2.2220 FCSc1ccc2ccccc2c1Br 62a_100015361967_200010089984 [0,2,0,0,0,0|1,1,0]=4 1231 B15R2.2220 FCSc1ccc2ccccc2c1Br 62a_200010089984_100015361967 [0,2,0,0,0,0|1,1,0]=4 1232 B15R2.2220 FCSc1ccc2ccccc2c1F 62a_100009832041_100015361967 [0,2,0,0,0,0|1,1,0]=4 1233 B15R2.2220 FCSc1ccc2ccccc2c1F 62a_100015361967_100009832041 [0,2,0,0,0,0|1,1,0]=4 1234 B15R2.2220 Nc1c(ccc2c1cccc2)OCF 34a_100000007056_100015361967 [0,2,0,0,0,0|1,0,0]=3 1235 B15R2.2220 Nc1c(ccc2c1cccc2)OCF 7a_100000007056_100015361967 [0,2,0,0,0,0|1,0,0]=3 1236 B15R2.2220 Nc1c(ccc2c1cccc2)SCF 62a_100009817101_100015361967 [0,2,0,0,0,0|1,1,0]=4 1237 B15R2.2220 Oc1c(ccc2c1cccc2)NCF 34a_100000007060_100015361967 [0,2,0,0,0,0|1,0,0]=3 1238 B15R2.2220 Oc1c(ccc2c1cccc2)SCF 62a_100015361967_100009996032 [0,2,0,0,0,0|0,1,0]=3 1239 B15R2.2220 Oc1c(ccc2c1nccc2)SCF 62a_100015361967_100009816563 [0,2,0,0,0,0|1,1,0]=4 1240 B15R2.2220 [13CH3]SCc1ccc2ccccc2c1Br 62a_100009813938_200025704644 [0,2,0,0,0,0|1,1,0]=4 1241 B15R2.2220 [13CH3]SCc1ccc2ccccc2c1Br 62a_200025704644_100009813938 [0,2,0,0,0,0|1,1,0]=4 1242 B15R2.4774 COc1ccc2ccc(cc2c1O)C 271570a_203496583355_203437268721 [0,2,0,0,0,0|0,0,0]=2 1243 B15R2.4774 N#Cc1cnc2ccc(cc2c1O)F 271570a_203496583355_200011221695 [0,2,0,0,0,0|2,0,0]=4 1244 B15R2.4778 COc1ccc2cc(ccc2c1Br)Br 34a_100009812206_200000210301 [0,2,0,0,0,0|1,0,0]=3 1245 B15R2.4778 COc1ccc2cc(ccc2c1Br)Br 7a_100009812206_200000210301 [0,2,0,0,0,0|1,0,0]=3 1246 B15R2.4778 COc1ccc2cc(ccc2c1F)Br 34a_100010730138_200000210301 [0,2,0,0,0,0|1,0,0]=3 1247 B15R2.4778 COc1ccc2cc(ccc2c1F)Br 7a_100010730138_200000210301 [0,2,0,0,0,0|1,0,0]=3 1248 B15R2.4778 COc1ccc2nc(ccc2c1Br)C 34a_100010269489_200000210301 [0,2,0,0,0,0|2,0,0]=4 1249 B15R2.4778 COc1ccc2nc(ccc2c1Br)C 7a_100010269489_200000210301 [0,2,0,0,0,0|2,0,0]=4 1250 B15R2.4778 COc1ccc2nc(ccc2c1O)C 271570a_203496583355_100010269488 [0,2,0,0,0,0|1,0,0]=3 1251 B15R2.4778 Cc1ccc2c(c(ccc2n1)O[13CH3])Br 34a_100010269489_200025704644 [0,2,0,0,0,0|2,0,0]=4 1252 B15R2.4778 Cc1ccc2c(c(ccc2n1)O[13CH3])Br 7a_100010269489_200025704644 [0,2,0,0,0,0|2,0,0]=4 1253 B15R2.4778 N#Cc1cnc2cc(ccc2c1O)F 271570a_203496583355_200011934548 [0,2,0,0,0,0|2,0,0]=4 1254 B15R2.4778 [13CH3]Oc1ccc2cc(ccc2c1Br)Br 34a_100009812206_200025704644 [0,2,0,0,0,0|1,0,0]=3 1255 B15R2.4778 [13CH3]Oc1ccc2cc(ccc2c1Br)Br 7a_100009812206_200025704644 [0,2,0,0,0,0|1,0,0]=3 1256 B15R2.4778 [13CH3]Oc1ccc2cc(ccc2c1F)Br 34a_100010730138_200025704644 [0,2,0,0,0,0|1,0,0]=3 1257 B15R2.4778 [13CH3]Oc1ccc2cc(ccc2c1F)Br 7a_100010730138_200025704644 [0,2,0,0,0,0|1,0,0]=3 1258 B15R2.19973 C=Cc1cc(c2cccnc2c1O)Cl 271570a_100011290941_100000211503 [0,2,0,0,0,0|2,0,0]=4 1259 B15R2.19973 COc1cc(c2ncccc2c1F)O 271570a_203496583355_100010742067 [0,2,0,0,0,0|2,0,0]=4 1260 B15R2.19973 CSc1cc(c2cccnc2c1O)Cl 62a_200000210301_100000211503 [0,2,0,0,0,0|1,1,0]=4 1261 B15R2.19973 O=Cc1cc(c2ccccc2c1F)O 271570a_203496583355_100010235050 [0,2,0,0,0,0|1,0,1]=4 1262 B15R2.19973 [13CH3]Sc1cc(c2cccnc2c1O)Cl 62a_200025704644_100000211503 [0,2,0,0,0,0|1,1,0]=4 1263 B15R2.1162 C=C(C)c1c(ccc2c1cccc2)Br 271570a_100000694244_100010090040 [0,2,0,0,0,0|2,0,0]=4 1264 B15R2.1162 C=C(C)c1c(ccc2c1cccc2)C 271570a_100000694244_100000759710 [0,2,0,0,0,0|2,0,0]=4 1265 B15R2.1162 C=C(C)c1c(ccc2c1cccc2)N 271570a_100000694244_100000705303 [0,2,0,0,0,0|2,0,0]=4 1266 B15R2.1162 C=C(C)c1c(ccc2c1cccc2)O 271570a_100000694244_100000183829 [0,2,0,0,0,0|1,0,0]=3 1267 B15R2.1162 C=C(C)c1c(ccc2c1cncc2)O 271570a_100000694244_200010115057 [0,2,0,0,0,0|2,0,0]=4 1268 B15R2.1162 C=C(C)c1c(ccc2c1nccc2)O 271570a_100000694244_100010173343 [0,2,0,0,0,0|2,0,0]=4 1269 B15R2.1162 CC(=O)c1c(ccc2c1cccc2)C 1458a_100011933975_200000210301 [0,2,0,0,0,0|1,0,1]=4 1270 B15R2.1162 CC(=O)c1c(ccc2c1cccc2)O 1458a_100011219592_200000210301 [0,2,0,0,0,0|0,0,1]=3 1271 B15R2.1162 Cc1ccc2ccccc2c1C(=O)[13CH3] 1458a_100011933975_200025704644 [0,2,0,0,0,0|1,0,1]=4 1272 B15R2.1162 [13CH3]C(=O)c1c(ccc2c1cccc2)O 1458a_100011219592_200025704644 [0,2,0,0,0,0|0,0,1]=3 1273 B15R2.5773 C=Cc1c(ccc2c1ccc(n2)C)O 271570a_100011290941_100010269489 [0,2,0,0,0,0|2,0,0]=4 1274 B15R2.5773 CSc1c(ccc2c1ccc(n2)C)O 62a_200000210301_100010269489 [0,2,0,0,0,0|1,1,0]=4 1275 B15R2.5773 Cc1ccc2c(c(ccc2n1)O)S[13CH3] 62a_200025704644_100010269489 [0,2,0,0,0,0|1,1,0]=4 1276 B15R2.6124 CNc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200000210301 [0,2,0,0,0,0|2,0,0]=4 1277 B15R2.6124 CNc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200000210301 [0,2,0,0,0,0|2,0,0]=4 1278 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200000210301 [0,2,0,0,0,0|1,0,0]=3 1279 B15R2.6124 COc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200000210301 [0,2,0,0,0,0|1,0,0]=3 1280 B15R2.6124 COc1c(cc(c2c1nccc2)Br)Br 7a_100000211973_200000210301 [0,2,0,0,0,0|2,0,0]=4 1281 B15R2.6124 COc1c(cc(c2c1nccc2)Cl)Br 34a_100009813450_200000210301 [0,2,0,0,0,0|2,0,0]=4 1282 B15R2.6124 COc1c(cc(c2c1nccc2)Cl)Br 7a_100009813450_200000210301 [0,2,0,0,0,0|2,0,0]=4 1283 B15R2.6124 COc1c(cc(c2c1nccc2)Cl)Cl 34a_100000019840_200000210301 [0,2,0,0,0,0|2,0,0]=4 1284 B15R2.6124 COc1c(cc(c2c1nccc2)Cl)Cl 7a_100000019840_200000210301 [0,2,0,0,0,0|2,0,0]=4 1285 B15R2.6124 COc1c(cc(c2c1nccc2)Cl)I 7a_100000211503_200000210301 [0,2,0,0,0,0|2,0,0]=4 1286 B15R2.6124 COc1c(cc(c2c1nccc2)I)I 7a_100000188416_200000210301 [0,2,0,0,0,0|2,0,0]=4 1287 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Br)Br 34a_100012339475_200025704644 [0,2,0,0,0,0|2,0,0]=4 1288 B15R2.6124 [13CH3]Nc1c(cc(c2c1cccc2)Cl)Cl 34a_100010097187_200025704644 [0,2,0,0,0,0|2,0,0]=4 1289 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 34a_100000042667_200025704644 [0,2,0,0,0,0|1,0,0]=3 1290 B15R2.6124 [13CH3]Oc1c(cc(c2c1cccc2)Cl)Cl 7a_100000042667_200025704644 [0,2,0,0,0,0|1,0,0]=3 1291 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Br)Br 7a_100000211973_200025704644 [0,2,0,0,0,0|2,0,0]=4 1292 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Cl)Br 34a_100009813450_200025704644 [0,2,0,0,0,0|2,0,0]=4 1293 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Cl)Br 7a_100009813450_200025704644 [0,2,0,0,0,0|2,0,0]=4 1294 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Cl)Cl 34a_100000019840_200025704644 [0,2,0,0,0,0|2,0,0]=4 1295 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Cl)Cl 7a_100000019840_200025704644 [0,2,0,0,0,0|2,0,0]=4 1296 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)Cl)I 7a_100000211503_200025704644 [0,2,0,0,0,0|2,0,0]=4 1297 B15R2.6124 [13CH3]Oc1c(cc(c2c1nccc2)I)I 7a_100000188416_200025704644 [0,2,0,0,0,0|2,0,0]=4 1298 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)Br 271570a_100015277604_100010090040 [0,2,0,0,0,0|2,0,0]=4 1299 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)C 271570a_100015277604_100000759710 [0,2,0,0,0,0|2,0,0]=4 1300 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)N 271570a_100015277604_100000705303 [0,2,0,0,0,0|2,0,0]=4 1301 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)O 271570a_100015277604_100000183829 [0,2,0,0,0,0|1,0,0]=3 1302 B15R2.9941 C=C=Cc1c(ccc2c1cncc2)O 271570a_100015277604_200010115057 [0,2,0,0,0,0|2,0,0]=4 1303 B15R2.9941 C=C=Cc1c(ccc2c1nccc2)O 271570a_100015277604_100010173343 [0,2,0,0,0,0|2,0,0]=4 1304 B15R2.9941 CC=Cc1c(ccc2c1cccc2)Br 271570a_100016259895_100010090040 [0,2,0,0,0,0|2,0,0]=4 1305 B15R2.9941 CC=Cc1c(ccc2c1cccc2)C 271570a_100016259895_100000759710 [0,2,0,0,0,0|2,0,0]=4 1306 B15R2.9941 CC=Cc1c(ccc2c1cccc2)N 271570a_100016259895_100000705303 [0,2,0,0,0,0|2,0,0]=4 1307 B15R2.9941 CC=Cc1c(ccc2c1cccc2)O 271570a_100016259895_100000183829 [0,2,0,0,0,0|1,0,0]=3 1308 B15R2.9941 CC=Cc1c(ccc2c1cncc2)O 271570a_100016259895_200010115057 [0,2,0,0,0,0|2,0,0]=4 1309 B15R2.9941 CC=Cc1c(ccc2c1nccc2)O 271570a_100016259895_100010173343 [0,2,0,0,0,0|2,0,0]=4 1310 B15R2.9941 CCNc1c(ccc2c1cccc2)Br 34a_100009817101_100000210202 [0,2,0,0,0,0|2,0,0]=4 1311 B15R2.9941 CCNc1c(ccc2c1cccc2)C 34a_100000688109_100000210202 [0,2,0,0,0,0|2,0,0]=4 1312 B15R2.9941 CCNc1c(ccc2c1cccc2)Cl 34a_200009860907_100000210202 [0,2,0,0,0,0|2,0,0]=4 1313 B15R2.9941 CCNc1c(ccc2c1cccc2)O 34a_100000007056_100000210202 [0,2,0,0,0,0|1,0,0]=3 1314 B15R2.9941 CCOc1c(ccc2c1cccc2)Br 34a_100009996032_100000210202 [0,2,0,0,0,0|1,0,0]=3 1315 B15R2.9941 CCOc1c(ccc2c1cccc2)Br 7a_100009996032_100000210202 [0,2,0,0,0,0|1,0,0]=3 1316 B15R2.9941 CCOc1c(ccc2c1cccc2)C 34a_100000039261_100000210202 [0,2,0,0,0,0|1,0,0]=3 1317 B15R2.9941 CCOc1c(ccc2c1cccc2)C 7a_100000039261_100000210202 [0,2,0,0,0,0|1,0,0]=3 1318 B15R2.9941 CCOc1c(ccc2c1cccc2)N 34a_100000007060_100000210202 [0,2,0,0,0,0|1,0,0]=3 1319 B15R2.9941 CCOc1c(ccc2c1nccc2)Br 34a_100009816563_100000210202 [0,2,0,0,0,0|2,0,0]=4 1320 B15R2.9941 CCOc1c(ccc2c1nccc2)Cl 34a_100000700379_100000210202 [0,2,0,0,0,0|2,0,0]=4 1321 B15R2.9941 CCOc1c(ccc2c1nccc2)Cl 7a_100000700379_100000210202 [0,2,0,0,0,0|2,0,0]=4 1322 B15R2.9941 CCSc1c(ccc2c1cccc2)Br 62a_100000210202_100010090040 [0,2,0,0,0,0|1,1,0]=4 1323 B15R2.9941 CCSc1c(ccc2c1cccc2)Br 62a_100010090040_100000210202 [0,2,0,0,0,0|1,1,0]=4 1324 B15R2.9941 CCSc1c(ccc2c1cccc2)C 62a_100000210202_100000759710 [0,2,0,0,0,0|1,1,0]=4 1325 B15R2.9941 CCSc1c(ccc2c1cccc2)C 62a_100000759710_100000210202 [0,2,0,0,0,0|1,1,0]=4 1326 B15R2.9941 CCSc1c(ccc2c1cccc2)N 62a_100000210202_100000705303 [0,2,0,0,0,0|1,1,0]=4 1327 B15R2.9941 CCSc1c(ccc2c1cccc2)N 62a_100000705303_100000210202 [0,2,0,0,0,0|1,1,0]=4 1328 B15R2.9941 CCSc1c(ccc2c1cccc2)O 62a_100000210202_100000183829 [0,2,0,0,0,0|0,1,0]=3 1329 B15R2.9941 CCSc1c(ccc2c1cncc2)O 62a_100000210202_200010115057 [0,2,0,0,0,0|1,1,0]=4 1330 B15R2.9941 CCSc1c(ccc2c1nccc2)O 62a_100000210202_100010173343 [0,2,0,0,0,0|1,1,0]=4 1331 B15R2.9941 CNCc1c(ccc2c1cccc2)Br 207a_100102657272_100010090029 [0,2,0,0,0,0|2,0,0]=4 1332 B15R2.9941 CNCc1c(ccc2c1cccc2)Br 26a_100102657272_100009996032 [0,2,0,0,0,0|2,0,0]=4 1333 B15R2.9941 CNCc1c(ccc2c1cccc2)Br 270004a_106832991635_100010090029 [0,2,0,0,0,0|2,0,0]=4 1334 B15R2.9941 CNCc1c(ccc2c1cccc2)C 207a_100102657272_100011361466 [0,2,0,0,0,0|2,0,0]=4 1335 B15R2.9941 CNCc1c(ccc2c1cccc2)C 2230a_106832991635_100000689653 [0,2,0,0,0,0|2,0,0]=4 1336 B15R2.9941 CNCc1c(ccc2c1cccc2)C 270004a_106832991635_100011361466 [0,2,0,0,0,0|2,0,0]=4 1337 B15R2.9941 CNCc1c(ccc2c1cccc2)C 34a_100102657272_100000689653 [0,2,0,0,0,0|2,0,0]=4 1338 B15R2.9941 CNCc1c(ccc2c1cccc2)C 7a_106832991635_100000689653 [0,2,0,0,0,0|2,0,0]=4 1339 B15R2.9941 COCc1c(ccc2c1cccc2)C 34a_100138415774_100000689653 [0,2,0,0,0,0|1,0,0]=3 1340 B15R2.9941 COCc1c(ccc2c1nccc2)Cl 34a_100000698065_200000210301 [0,2,0,0,0,0|2,0,0]=4 1341 B15R2.9941 CSCc1c(ccc2c1cccc2)C 62a_100000689653_200000210301 [0,2,0,0,0,0|1,1,0]=4 1342 B15R2.9941 CSCc1c(ccc2c1cccc2)C 62a_200000210301_100000689653 [0,2,0,0,0,0|1,1,0]=4 1343 B15R2.9941 Cc1ccc2ccccc2c1CS[13CH3] 62a_100000689653_200025704644 [0,2,0,0,0,0|1,1,0]=4 1344 B15R2.9941 Cc1ccc2ccccc2c1CS[13CH3] 62a_200025704644_100000689653 [0,2,0,0,0,0|1,1,0]=4 1345 B15R2.9941 Cc1ccc2ccccc2c1NCF 34a_100000688109_100015361967 [0,2,0,0,0,0|2,0,0]=4 1346 B15R2.9941 Cc1ccc2ccccc2c1OCF 34a_100000039261_100015361967 [0,2,0,0,0,0|1,0,0]=3 1347 B15R2.9941 Cc1ccc2ccccc2c1OCF 7a_100000039261_100015361967 [0,2,0,0,0,0|1,0,0]=3 1348 B15R2.9941 Cc1ccc2ccccc2c1SCF 62a_100000759710_100015361967 [0,2,0,0,0,0|1,1,0]=4 1349 B15R2.9941 Cc1ccc2ccccc2c1SCF 62a_100015361967_100000759710 [0,2,0,0,0,0|1,1,0]=4 1350 B15R2.9941 FCNc1c(ccc2c1cccc2)Br 34a_100009817101_100015361967 [0,2,0,0,0,0|2,0,0]=4 1351 B15R2.9941 FCNc1c(ccc2c1cccc2)Cl 34a_200009860907_100015361967 [0,2,0,0,0,0|2,0,0]=4 1352 B15R2.9941 FCOc1c(ccc2c1cccc2)Br 34a_100009996032_100015361967 [0,2,0,0,0,0|1,0,0]=3 1353 B15R2.9941 FCOc1c(ccc2c1cccc2)Br 7a_100009996032_100015361967 [0,2,0,0,0,0|1,0,0]=3 1354 B15R2.9941 FCOc1c(ccc2c1nccc2)Br 34a_100009816563_100015361967 [0,2,0,0,0,0|2,0,0]=4 1355 B15R2.9941 FCOc1c(ccc2c1nccc2)Cl 34a_100000700379_100015361967 [0,2,0,0,0,0|2,0,0]=4 1356 B15R2.9941 FCOc1c(ccc2c1nccc2)Cl 7a_100000700379_100015361967 [0,2,0,0,0,0|2,0,0]=4 1357 B15R2.9941 FCSc1c(ccc2c1cccc2)Br 62a_100010090040_100015361967 [0,2,0,0,0,0|1,1,0]=4 1358 B15R2.9941 FCSc1c(ccc2c1cccc2)Br 62a_100015361967_100010090040 [0,2,0,0,0,0|1,1,0]=4 1359 B15R2.9941 Nc1ccc2ccccc2c1OCF 34a_100000007060_100015361967 [0,2,0,0,0,0|1,0,0]=3 1360 B15R2.9941 Nc1ccc2ccccc2c1SCF 62a_100000705303_100015361967 [0,2,0,0,0,0|1,1,0]=4 1361 B15R2.9941 Nc1ccc2ccccc2c1SCF 62a_100015361967_100000705303 [0,2,0,0,0,0|1,1,0]=4 1362 B15R2.9941 Oc1ccc2ccccc2c1NCF 34a_100000007056_100015361967 [0,2,0,0,0,0|1,0,0]=3 1363 B15R2.9941 Oc1ccc2ccccc2c1SCF 62a_100015361967_100000183829 [0,2,0,0,0,0|0,1,0]=3 1364 B15R2.9941 Oc1ccc2cccnc2c1SCF 62a_100015361967_100010173343 [0,2,0,0,0,0|1,1,0]=4 1365 B15R2.9941 Oc1ccc2ccncc2c1SCF 62a_100015361967_200010115057 [0,2,0,0,0,0|1,1,0]=4 1366 B15R2.9941 [13CH3]OCc1c(ccc2c1nccc2)Cl 34a_100000698065_200025704644 [0,2,0,0,0,0|2,0,0]=4 1367 B15R2.4807 COc1ccc2ccc(c(c2c1)F)F 34a_100000100812_200000210301 [0,2,0,0,0,0|2,0,0]=4 1368 B15R2.4807 COc1ccc2ccc(c(c2c1)F)F 7a_100000100812_200000210301 [0,2,0,0,0,0|2,0,0]=4 1369 B15R2.4807 [13CH3]Oc1ccc2ccc(c(c2c1)F)F 34a_100000100812_200025704644 [0,2,0,0,0,0|2,0,0]=4 1370 B15R2.4807 [13CH3]Oc1ccc2ccc(c(c2c1)F)F 7a_100000100812_200025704644 [0,2,0,0,0,0|2,0,0]=4 1371 B15R2.63910 Cc1cc(=O)c2ccc(c(c2[nH]1)C)O 271570a_203496583355_100012349997 [0,2,0,0,0,0|2,0,0]=4 1372 B15R2.9032 Cc1c(c(=O)n(c2c1cccc2)C)O 271570a_203496583355_100010739255 [0,2,0,0,0,0|2,0,0]=4 1373 B15R2.20926 Cc1cnc2c(cccc2c1O)C#N 271570a_203496583355_100010080166 [0,2,0,0,0,0|2,0,0]=4 1374 B15R2.63893 Cc1c(c(=O)oc2c1ccc(c2)O)O 271570a_203496583355_200009996780 [0,2,0,0,0,0|2,0,0]=4 1375 B15R2.89401 C=Cc1ccc2c(c(ccc2c1)O)F 271570a_100011290941_100010730138 [0,2,0,0,0,0|1,0,0]=3 1376 B15R2.89401 C=Cc1ccc2c(c1)C=CC(=O)C2=O 271570a_100011290941_100009812793 [0,2,0,0,0,0|0,0,2]=4 1377 B15R2.89401 COc1ccc2c(=O)c(coc2c1)O 271570a_203496583355_100010272328 [0,2,0,0,0,0|1,0,1]=4 1378 B15R2.89401 CSc1ccc2c(c(ccc2c1)O)F 62a_100010730138_200000210301 [0,2,0,0,0,0|1,0,0]=3 1379 B15R2.89401 CSc1ccc2c(c(ccc2c1)O)F 62a_200000210301_100010730138 [0,2,0,0,0,0|1,0,0]=3 1380 B15R2.89401 CSc1ccc2c(c1)C=CC(=O)C2=O 62a_100009812793_200000210301 [0,2,0,0,0,0|0,0,2]=4 1381 B15R2.89401 CSc1ccc2c(c1)C=CC(=O)C2=O 62a_200000210301_100009812793 [0,2,0,0,0,0|0,0,2]=4 1382 B15R2.89401 [13CH3]Sc1ccc2c(c(ccc2c1)O)F 62a_100010730138_200025704644 [0,2,0,0,0,0|1,0,0]=3 1383 B15R2.89401 [13CH3]Sc1ccc2c(c(ccc2c1)O)F 62a_200025704644_100010730138 [0,2,0,0,0,0|1,0,0]=3 1384 B15R2.89401 [13CH3]Sc1ccc2c(c1)C=CC(=O)C2=O 62a_100009812793_200025704644 [0,2,0,0,0,0|0,0,2]=4 1385 B15R2.89401 [13CH3]Sc1ccc2c(c1)C=CC(=O)C2=O 62a_200025704644_100009812793 [0,2,0,0,0,0|0,0,2]=4 1386 B13R2.54 C=Cc1cc2cccc(c2[nH]1)Br 271570a_100011290941_100135389745 [0,0,1,1,0,0|2,0,0]=4 1387 B13R2.54 O=Cc1cc2cccc(c2s1)O 271570a_203496583355_100010110135 [0,0,1,1,0,0|1,1,0]=4 1388 B13R2.10 Cc1csc(c1)c2ccccc2 271570a_100000038307_100000210277 [0,0,1,1,0,0|1,1,0]=4 1389 B13R2.10 Cc1csc(c1)c2ccccc2 271570a_100011218836_100009876951 [0,0,1,1,0,0|1,1,0]=4 1390 B13R2.10 Oc1c[nH]c(n1)c2ccccc2 271570a_203496583355_200010210587 [0,0,1,1,0,0|2,0,0]=4 1391 B13R2.10 Oc1cc(n[nH]1)c2ccccc2 271570a_203496583355_114929179799 [0,0,1,1,0,0|2,0,0]=4 1392 B13R2.10 Oc1ccc(s1)c2ccccc2 271570a_203496583355_100009814279 [0,0,1,1,0,0|2,0,0]=4 1393 B13R2.10 Oc1cnc(o1)c2ccccc2 271570a_203496583355_100009814072 [0,0,1,1,0,0|2,0,0]=4 1394 B13R2.10 Oc1cnc(s1)c2ccccc2 271570a_203496583355_100000726391 [0,0,1,1,0,0|2,0,0]=4 1395 B13R2.10 Oc1cnn(c1)c2ccccc2 271570a_203496583355_100011260827 [0,0,1,1,0,0|2,0,0]=4 1396 B13R2.10 Oc1coc(n1)c2ccccc2 271570a_203496583355_100010163736 [0,0,1,1,0,0|1,0,0]=3 1397 B13R2.10 Oc1noc(n1)c2ccccc2 271570a_203496583355_200000701163 [0,0,1,1,0,0|2,0,0]=4 1398 B13R2.15 Brc1ccsc1c2ccccc2 271570a_100011218836_100012361411 [0,0,1,1,0,0|1,1,0]=4 1399 B13R2.15 Cc1ccsc1c2ccccc2 271570a_100000734444_100000210277 [0,0,1,1,0,0|1,1,0]=4 1400 B13R2.15 Cc1ccsc1c2ccccc2 271570a_100011218836_100000742657 [0,0,1,1,0,0|1,1,0]=4 1401 B13R2.15 Oc1c[nH]nc1c2ccccc2 271570a_203496583355_100011471533 [0,0,1,1,0,0|2,0,0]=4 1402 B13R2.15 Oc1ccnn1c2ccccc2 271570a_203496583355_100011001034 [0,0,1,1,0,0|2,0,0]=4 1403 B13R2.582 C=Cc1cccc2c1C(=O)CO2 271570a_100011290941_100010205902 [0,0,1,1,0,0|0,0,2]=4 1404 B13R2.582 C=Cc1cccc2c1c(c[nH]2)C 271570a_100011290941_100010194227 [0,0,1,1,0,0|2,0,0]=4 1405 B13R2.582 C=Cc1cccc2c1c(no2)N 271570a_100011290941_100012361266 [0,0,1,1,0,0|2,0,0]=4 1406 B13R2.611 C=Cc1ccc(c2c1cc[nH]2)C 271570a_100011290941_100009820812 [0,0,1,1,0,0|2,0,0]=4 1407 B13R2.611 C=Cc1ccc(c2c1cc[nH]2)F 271570a_100011290941_100010006601 [0,0,1,1,0,0|2,0,0]=4 1408 B13R2.611 C=Cc1ccc(c2c1cco2)F 271570a_100011290941_100010248603 [0,0,1,1,0,0|1,0,0]=3 1409 B13R2.611 C=Cc1ccc(c2c1cco2)O 271570a_100011290941_200020711608 [0,0,1,1,0,0|0,0,0]=2 1410 B13R2.611 CSc1ccc(c2c1cco2)O 62a_200000210301_200020711608 [0,0,1,1,0,0|1,0,1]=4 1411 B13R2.611 [13CH3]Sc1ccc(c2c1cco2)O 62a_200025704644_200020711608 [0,0,1,1,0,0|1,0,1]=4 1412 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [1,0,0,0,1,0|2,0,0]=4 1413 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [1,0,0,0,1,0|2,0,0]=4 1414 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [1,0,0,0,1,0|2,0,0]=4 1415 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [1,0,0,0,1,0|2,0,0]=4 1416 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [1,0,0,0,1,0|2,0,0]=4 1417 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [1,0,0,0,1,0|2,0,0]=4 1418 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [1,0,0,0,1,0|1,0,0]=3 1419 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [1,0,0,0,1,0|2,0,0]=4 1420 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [1,0,0,0,1,0|1,0,0]=3 1421 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [1,0,0,0,1,0|2,0,0]=4 1422 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [1,0,0,0,1,0|2,0,0]=4 1423 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [1,0,0,0,1,0|2,0,0]=4 1424 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [1,0,0,0,1,0|2,0,0]=4 1425 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,0,0,0,1,0|2,0,0]=4 1426 B11R2.1 Oc1ncn2c1cccc2 271570a_203496583355_100000688344 [1,0,0,0,1,0|2,0,0]=4 1427 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [1,0,0,0,1,0|1,0,0]=3 1428 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,0,0,0,1,0|1,0,0]=3 1429 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [1,0,0,0,1,0|1,0,0]=3 1430 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [1,0,0,0,1,0|2,0,0]=4 1431 B11R2.10 Oc1cn2ccccc2n1 271570a_203496583355_100009819586 [1,0,0,0,1,0|2,0,0]=4 1432 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [1,0,0,0,1,0|2,0,0]=4 1433 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [1,0,0,0,1,0|2,0,0]=4 1434 B11R2.36 Oc1cc2[nH]ccc2cn1 271570a_203496583355_100000089685 [1,0,0,0,1,0|2,0,0]=4 1435 B11R2.36 Oc1cc2cc[nH]c2cn1 271570a_203496583355_100009864809 [1,0,0,0,1,0|2,0,0]=4 1436 B11R2.36 Oc1cc2sccc2cn1 271570a_203496583355_200016184645 [1,0,0,0,1,0|2,0,0]=4 1437 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,0,0,0,1,0|1,0,0]=3 1438 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [1,0,0,0,1,0|2,0,0]=4 1439 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,0,0,0,1,0|2,0,0]=4 1440 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,0,0,0,1,0|2,0,0]=4 1441 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,0,0,0,1,0|0,0,1]=3 1442 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,0,1,0|0,0,1]=3 1443 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,0,1,0|1,0,0]=3 1444 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [1,0,0,0,1,0|2,0,0]=4 1445 B11R2.36 Oc1ccc2ccnn2c1 271570a_203496583355_100009820231 [1,0,0,0,1,0|2,0,0]=4 1446 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,0,0,0,1,0|1,0,0]=3 1447 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,0,0,0,1,0|1,0,0]=3 1448 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,0,0,0,1,0|2,0,0]=4 1449 B11R2.36 Oc1ccc2cncn2c1 271570a_203496583355_100009887162 [1,0,0,0,1,0|2,0,0]=4 1450 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,0,0,0,1,0|2,0,0]=4 1451 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,0,0,0,1,0|1,0,0]=3 1452 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,0,0,0,1,0|2,0,0]=4 1453 B11R2.36 Oc1ccc2nccn2c1 271570a_203496583355_100000746083 [1,0,0,0,1,0|2,0,0]=4 1454 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,0,0,0,1,0|2,0,0]=4 1455 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [1,0,0,0,1,0|2,0,0]=4 1456 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,0,0,0,1,0|1,0,0]=3 1457 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [1,0,0,0,1,0|2,0,0]=4 1458 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,0,0,0,1,0|2,0,0]=4 1459 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,0,0,0,1,0|2,0,0]=4 1460 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,0,0,0,1,0|1,0,0]=3 1461 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [1,0,0,0,1,0|2,0,0]=4 1462 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [1,0,0,0,1,0|2,0,0]=4 1463 B11R2.36 Oc1ccn2ccnc2c1 271570a_203496583355_100009816855 [1,0,0,0,1,0|2,0,0]=4 1464 B11R2.36 Oc1ccn2nccc2c1 271570a_203496583355_100000763084 [1,0,0,0,1,0|2,0,0]=4 1465 B11R2.36 Oc1cnc2[nH]ccc2c1 271570a_203496583355_100000760471 [1,0,0,0,1,0|2,0,0]=4 1466 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [1,0,0,0,1,0|2,0,0]=4 1467 B11R2.36 Oc1cnc2sccc2c1 271570a_203496583355_100010135160 [1,0,0,0,1,0|2,0,0]=4 1468 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,0,0,0,1,0|0,0,1]=3 1469 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,0,0,0,1,0|1,0,0]=3 1470 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,0,0,0,1,0|2,0,0]=4 1471 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,0,0,0,1,0|1,0,0]=3 1472 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,0,0,0,1,0|1,0,0]=3 1473 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,0,0,0,1,0|1,0,0]=3 1474 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [1,0,0,0,1,0|2,0,0]=4 1475 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,0,0,0,1,0|2,0,0]=4 1476 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [1,0,0,0,1,0|2,0,0]=4 1477 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,0,0,0,1,0|2,0,0]=4 1478 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [1,0,0,0,1,0|2,0,0]=4 1479 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,0,0,0,1,0|1,0,0]=3 1480 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,0,0,0,1,0|2,0,0]=4 1481 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,0,0,0,1,0|2,0,0]=4 1482 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,0,0,0,1,0|1,0,0]=3 1483 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [1,0,0,0,1,0|2,0,0]=4 1484 B11R2.106 Oc1cccc2n1ccn2 271570a_203496583355_100000762677 [1,0,0,0,1,0|2,0,0]=4 1485 B11R2.106 Oc1cccc2n1cnc2 271570a_203496583355_100009817730 [1,0,0,0,1,0|2,0,0]=4 1486 B11R2.106 Oc1cccc2n1ncc2 271570a_203496583355_100009817731 [1,0,0,0,1,0|2,0,0]=4 1487 B11R2.106 Oc1cccn2c1ccn2 271570a_203496583355_100010767162 [1,0,0,0,1,0|2,0,0]=4 1488 B11R2.106 Oc1cccn2c1cnc2 271570a_203496583355_100009857155 [1,0,0,0,1,0|2,0,0]=4 1489 B11R2.106 Oc1cccn2c1ncc2 271570a_203496583355_100011934911 [1,0,0,0,1,0|2,0,0]=4 1490 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [1,0,0,0,1,0|2,0,0]=4 1491 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [1,0,0,0,1,0|2,0,0]=4 1492 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [1,0,0,0,1,0|2,0,0]=4 1493 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [1,0,0,0,1,0|2,0,0]=4 1494 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [1,0,0,0,1,0|2,0,0]=4 1495 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [1,0,0,0,1,0|2,0,0]=4 1496 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [1,0,0,0,1,0|2,0,0]=4 1497 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [1,0,0,0,1,0|2,0,0]=4 1498 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [1,0,0,0,1,0|2,0,0]=4 1499 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [1,0,0,0,1,0|2,0,0]=4 1500 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [1,0,0,0,1,0|2,0,0]=4 1501 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [1,0,0,0,1,0|2,0,0]=4 1502 B11R2.106 Oc1nccn2c1ccc2 271570a_203496583355_100000094558 [1,0,0,0,1,0|2,0,0]=4 1503 B13R1.718 C=CC(=O)C/C=C/c1ccccc1 1458a_100000185746_100016265936 [0,0,1,0,0,1|1,0,1]=4 1504 B13R1.718 O=C(CO)C/C=C/c1ccccc1 1458a_100000210174_100016265936 [0,0,1,0,0,1|0,0,2]=4