0 B12R2.24 CN1CCc2ncccc2C1 2230a_100000699647_200000210301 [0,0,0,0,0,0|1,0,3]=4 1 B12R2.24 CN1CCc2ncccc2C1 269982a_100000699647_200000210301 [0,0,0,0,0,0|1,0,3]=4 2 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [0,0,0,0,0,0|3,0,0]=3 4 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,0|2,0,0]=2 5 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,0|3,0,0]=3 6 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [0,0,0,0,0,0|4,0,0]=4 8 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [0,0,0,0,0,0|3,0,0]=3 9 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [0,0,0,0,0,0|4,0,0]=4 10 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [0,0,0,0,0,0|3,0,0]=3 11 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.24 Oc1ccc2cnncc2c1 271570a_203496583355_100010198781 [0,0,0,0,0,0|4,0,0]=4 13 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [0,0,0,0,0,0|1,0,0]=1 14 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [0,0,0,0,0,0|2,0,0]=2 15 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [0,0,0,0,0,0|2,0,0]=2 16 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [0,0,0,0,0,0|3,0,0]=3 17 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [0,0,0,0,0,0|2,0,0]=2 18 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [0,0,0,0,0,0|2,0,0]=2 19 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,0|4,0,0]=4 21 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [0,0,0,0,0,0|3,0,0]=3 23 B12R2.24 Oc1cnc2nccnc2c1 271570a_203496583355_100000753224 [0,0,0,0,0,0|3,0,0]=3 24 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,0|4,0,0]=4 25 B12R2.24 [13CH3]N1CCc2ncccc2C1 2230a_100000699647_200025704644 [0,0,0,0,0,0|1,0,3]=4 26 B12R2.24 [13CH3]N1CCc2ncccc2C1 269982a_100000699647_200025704644 [0,0,0,0,0,0|1,0,3]=4 27 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,1,0,0,0,0|1,0,0]=2 29 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,1,0,0,0,0|3,0,0]=4 30 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [0,1,0,0,0,0|2,0,0]=3 31 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,0,0,0|1,0,0]=2 32 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,1,0,0,0,0|2,0,0]=3 33 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,0,0,0|2,0,0]=3 34 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,0|2,0,0]=3 35 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [0,1,0,0,0,0|1,0,0]=2 36 B13R2.32 Nc1c(ccc2c1ccnc2)O 271570a_203496583355_100010191621 [0,1,0,0,0,0|3,0,0]=4 37 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,1,0,0,0,0|3,0,0]=4 38 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,1,0,0,0,0|3,0,0]=4 39 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,0,0,0|2,0,0]=3 40 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [0,1,0,0,0,0|3,0,0]=4 41 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,1,0,0,0,0|1,0,0]=2 42 B13R2.32 Nc1ccc2nccnc2c1O 271570a_203496583355_100000729981 [0,1,0,0,0,0|2,0,0]=3 43 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [0,1,0,0,0,0|3,0,0]=4 44 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,1,0,0,0,0|3,0,0]=4 45 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,0|3,0,0]=4 46 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,1,0,0,0,0|3,0,0]=4 47 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,0,0,0|2,0,0]=3 48 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [0,1,0,0,0,0|3,0,0]=4 49 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [0,1,0,0,0,0|3,0,0]=4 50 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [0,1,0,0,0,0|3,0,0]=4 51 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,0|2,0,0]=3 52 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,0|2,0,0]=3 53 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,0|2,0,0]=3 54 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,0|2,0,0]=3 55 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [0,1,0,0,0,0|3,0,0]=4 56 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,1,0,0,0,0|3,0,0]=4 57 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,1,0,0,0,0|3,0,0]=4 58 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [0,1,0,0,0,0|3,0,0]=4 59 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,1,0,0,0,0|3,0,0]=4 60 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [0,1,0,0,0,0|2,0,1]=4 61 B13R2.57 C=Cc1cc2nccnc2cn1 271570a_100011290941_100010370699 [0,1,0,0,0,0|2,0,1]=4 62 B13R2.57 C=Cc1ccc2ccccc2c1 271570a_100011290941_100000233703 [0,1,0,0,0,0|1,0,1]=3 63 B13R2.57 C=Cc1ccc2ccccc2n1 271570a_100011290941_100011291633 [0,1,0,0,0,0|2,0,1]=4 64 B13R2.57 C=Cc1ccc2cccnc2c1 271570a_100011290941_100009816655 [0,1,0,0,0,0|2,0,1]=4 65 B13R2.57 C=Cc1ccc2ccncc2c1 271570a_100011290941_100000686496 [0,1,0,0,0,0|2,0,1]=4 66 B13R2.57 C=Cc1ccc2cnccc2c1 271570a_100011290941_100009816743 [0,1,0,0,0,0|2,0,1]=4 67 B13R2.57 C=Cc1ccc2ncccc2c1 271570a_100011290941_100000754243 [0,1,0,0,0,0|0,0,1]=2 68 B13R2.57 C=Cc1ccc2ncccc2n1 271570a_100011290941_100000073381 [0,1,0,0,0,0|1,0,1]=3 69 B13R2.57 C=Cc1ccc2nccnc2c1 271570a_100011290941_100011219451 [0,1,0,0,0,0|1,0,1]=3 70 B13R2.57 C=Cc1ccc2nccnc2n1 271570a_100011290941_100012351543 [0,1,0,0,0,0|2,0,1]=4 71 B13R2.57 C=Cc1ccc2ncncc2c1 271570a_100011290941_100009989443 [0,1,0,0,0,0|1,0,1]=3 72 B13R2.57 C=Cc1ccc2nnccc2c1 271570a_100011290941_100010209549 [0,1,0,0,0,0|1,0,1]=3 73 B13R2.57 C=Cc1cnc2ccccc2c1 271570a_100011290941_100000737414 [0,1,0,0,0,0|2,0,1]=4 74 B13R2.57 C=Cc1cnc2ncccc2n1 271570a_100011290941_100000084304 [0,1,0,0,0,0|2,0,1]=4 75 B13R2.57 C=Cc1cnc2nccnc2c1 271570a_100011290941_100000753224 [0,1,0,0,0,0|2,0,1]=4 76 B13R2.57 CNc1cc2nccnc2cn1 27a_100102657272_100000070204 [0,1,0,0,0,0|2,0,0]=3 77 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,1,0,0,0,0|1,0,0]=2 78 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,1,0,0,0,0|1,0,0]=2 79 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [0,1,0,0,0,0|2,0,0]=3 80 B13R2.57 CNc1ccc2cccnc2c1 34a_100102887122_200000210301 [0,1,0,0,0,0|2,0,0]=3 81 B13R2.57 CNc1ccc2cccnc2n1 27a_100102657272_100000075685 [0,1,0,0,0,0|3,0,0]=4 82 B13R2.57 CNc1ccc2ccncc2n1 27a_100102657272_100000020162 [0,1,0,0,0,0|3,0,0]=4 83 B13R2.57 CNc1ccc2cnccc2c1 34a_100000039641_200000210301 [0,1,0,0,0,0|2,0,0]=3 84 B13R2.57 CNc1ccc2cncnc2c1 27a_100102657272_100010185614 [0,1,0,0,0,0|3,0,0]=4 85 B13R2.57 CNc1ccc2ncccc2c1 34a_100011198106_200000210301 [0,1,0,0,0,0|0,0,0]=1 86 B13R2.57 CNc1ccc2ncccc2n1 27a_100102657272_100000073381 [0,1,0,0,0,0|1,0,0]=2 87 B13R2.57 CNc1ccc2nccnc2c1 27a_100102657272_100011219451 [0,1,0,0,0,0|1,0,0]=2 88 B13R2.57 CNc1ccc2nccnc2c1 34a_100011219565_200000210301 [0,1,0,0,0,0|1,0,0]=2 89 B13R2.57 CNc1ccc2nccnc2n1 27a_100102657272_100012351543 [0,1,0,0,0,0|2,0,0]=3 90 B13R2.57 CNc1cnc2ccccc2n1 27a_100102657272_100000756483 [0,1,0,0,0,0|3,0,0]=4 91 B13R2.57 CNc1cnc2ncccc2n1 27a_100102657272_100000084304 [0,1,0,0,0,0|2,0,0]=3 92 B13R2.57 CNc1cnc2nccnc2c1 27a_100102657272_100000753224 [0,1,0,0,0,0|2,0,0]=3 93 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [0,1,0,0,0,0|3,0,0]=4 94 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,1,0,0,0,0|1,0,0]=2 95 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,1,0,0,0,0|1,0,0]=2 96 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [0,1,0,0,0,0|2,0,0]=3 97 B13R2.57 COc1ccc2ccncc2c1 7a_100000752006_200000210301 [0,1,0,0,0,0|2,0,0]=3 98 B13R2.57 COc1ccc2cnccc2c1 34a_100000046372_200000210301 [0,1,0,0,0,0|2,0,0]=3 99 B13R2.57 COc1ccc2cnccc2c1 7a_100000046372_200000210301 [0,1,0,0,0,0|2,0,0]=3 100 B13R2.57 COc1ccc2ncccc2c1 34a_100011215586_200000210301 [0,1,0,0,0,0|0,0,0]=1 101 B13R2.57 COc1ccc2ncccc2c1 7a_100011215586_200000210301 [0,1,0,0,0,0|0,0,0]=1 102 B13R2.57 COc1ccc2nccnc2c1 34a_100000694412_200000210301 [0,1,0,0,0,0|1,0,0]=2 103 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,1,0,0,0,0|2,0,0]=3 104 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,1,0,0,0,0|2,0,0]=3 105 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [0,1,0,0,0,0|2,0,0]=3 106 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [0,1,0,0,0,0|2,0,0]=3 107 B13R2.57 CSc1cc2nccnc2cn1 62a_100010370699_200000210301 [0,1,0,0,0,0|2,0,0]=3 108 B13R2.57 CSc1cc2nccnc2cn1 62a_200000210301_100010370699 [0,1,0,0,0,0|2,0,0]=3 109 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [0,1,0,0,0,0|1,0,0]=2 110 B13R2.57 CSc1ccc2ccccc2n1 62a_100011291633_200000210301 [0,1,0,0,0,0|2,0,0]=3 111 B13R2.57 CSc1ccc2ccccc2n1 62a_200000210301_100011291633 [0,1,0,0,0,0|2,0,0]=3 112 B13R2.57 CSc1ccc2cccnc2c1 62a_200000210301_100009816655 [0,1,0,0,0,0|2,0,0]=3 113 B13R2.57 CSc1ccc2cccnc2n1 62a_100000075685_200000210301 [0,1,0,0,0,0|3,0,0]=4 114 B13R2.57 CSc1ccc2cccnc2n1 62a_200000210301_100000075685 [0,1,0,0,0,0|3,0,0]=4 115 B13R2.57 CSc1ccc2ccncc2c1 62a_100000686496_200000210301 [0,1,0,0,0,0|2,0,0]=3 116 B13R2.57 CSc1ccc2ccncc2c1 62a_200000210301_100000686496 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.57 CSc1ccc2ccncc2n1 62a_200000210301_100000020162 [0,1,0,0,0,0|3,0,0]=4 118 B13R2.57 CSc1ccc2cnccc2c1 62a_100009816743_200000210301 [0,1,0,0,0,0|2,0,0]=3 119 B13R2.57 CSc1ccc2cnccc2c1 62a_200000210301_100009816743 [0,1,0,0,0,0|2,0,0]=3 120 B13R2.57 CSc1ccc2cncnc2c1 62a_100010185614_200000210301 [0,1,0,0,0,0|3,0,0]=4 121 B13R2.57 CSc1ccc2cncnc2c1 62a_200000210301_100010185614 [0,1,0,0,0,0|3,0,0]=4 122 B13R2.57 CSc1ccc2cnncc2c1 62a_100010198781_200000210301 [0,1,0,0,0,0|3,0,0]=4 123 B13R2.57 CSc1ccc2cnncc2c1 62a_200000210301_100010198781 [0,1,0,0,0,0|3,0,0]=4 124 B13R2.57 CSc1ccc2ncccc2c1 62a_100011215947_200000210301 [0,1,0,0,0,0|0,0,0]=1 125 B13R2.57 CSc1ccc2ncccc2c1 62a_200000210301_100011215947 [0,1,0,0,0,0|0,0,0]=1 126 B13R2.57 CSc1ccc2ncccc2n1 62a_200000210301_100000073381 [0,1,0,0,0,0|1,0,0]=2 127 B13R2.57 CSc1ccc2nccnc2c1 62a_100011219451_200000210301 [0,1,0,0,0,0|1,0,0]=2 128 B13R2.57 CSc1ccc2nccnc2c1 62a_200000210301_100011219451 [0,1,0,0,0,0|1,0,0]=2 129 B13R2.57 CSc1ccc2nccnc2n1 62a_100012351543_200000210301 [0,1,0,0,0,0|2,0,0]=3 130 B13R2.57 CSc1ccc2nccnc2n1 62a_200000210301_100012351543 [0,1,0,0,0,0|2,0,0]=3 131 B13R2.57 CSc1ccc2ncncc2c1 62a_100009989443_200000210301 [0,1,0,0,0,0|1,0,0]=2 132 B13R2.57 CSc1ccc2ncncc2c1 62a_200000210301_100009989443 [0,1,0,0,0,0|1,0,0]=2 133 B13R2.57 CSc1ccc2nnccc2c1 62a_100010209549_200000210301 [0,1,0,0,0,0|1,0,0]=2 134 B13R2.57 CSc1ccc2nnccc2c1 62a_200000210301_100010209549 [0,1,0,0,0,0|1,0,0]=2 135 B13R2.57 CSc1cnc2ccccc2c1 62a_200000210301_100000737414 [0,1,0,0,0,0|2,0,0]=3 136 B13R2.57 CSc1cnc2ccccc2n1 62a_100000756483_200000210301 [0,1,0,0,0,0|3,0,0]=4 137 B13R2.57 CSc1cnc2ccccc2n1 62a_200000210301_100000756483 [0,1,0,0,0,0|3,0,0]=4 138 B13R2.57 CSc1cnc2cccnc2c1 62a_100010246316_200000210301 [0,1,0,0,0,0|3,0,0]=4 139 B13R2.57 CSc1cnc2cccnc2c1 62a_200000210301_100010246316 [0,1,0,0,0,0|3,0,0]=4 140 B13R2.57 CSc1cnc2ncccc2n1 62a_100000084304_200000210301 [0,1,0,0,0,0|2,0,0]=3 141 B13R2.57 CSc1cnc2ncccc2n1 62a_200000210301_100000084304 [0,1,0,0,0,0|2,0,0]=3 142 B13R2.57 CSc1cnc2nccnc2c1 62a_100000753224_200000210301 [0,1,0,0,0,0|2,0,0]=3 143 B13R2.57 CSc1cnc2nccnc2c1 62a_200000210301_100000753224 [0,1,0,0,0,0|2,0,0]=3 144 B13R2.57 CSc1ncc2ccccc2n1 62a_200000210301_100000097389 [0,1,0,0,0,0|3,0,0]=4 145 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,1,0,0,0,0|1,0,0]=2 146 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,1,0,0,0,0|1,0,0]=2 147 B13R2.57 [13CH3]Nc1ccc2cccnc2c1 34a_100102887122_200025704644 [0,1,0,0,0,0|2,0,0]=3 148 B13R2.57 [13CH3]Nc1ccc2cnccc2c1 34a_100000039641_200025704644 [0,1,0,0,0,0|2,0,0]=3 149 B13R2.57 [13CH3]Nc1ccc2ncccc2c1 34a_100011198106_200025704644 [0,1,0,0,0,0|0,0,0]=1 150 B13R2.57 [13CH3]Nc1ccc2nccnc2c1 34a_100011219565_200025704644 [0,1,0,0,0,0|1,0,0]=2 151 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,1,0,0,0,0|1,0,0]=2 152 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,1,0,0,0,0|1,0,0]=2 153 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [0,1,0,0,0,0|2,0,0]=3 154 B13R2.57 [13CH3]Oc1ccc2ccncc2c1 7a_100000752006_200025704644 [0,1,0,0,0,0|2,0,0]=3 155 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 34a_100000046372_200025704644 [0,1,0,0,0,0|2,0,0]=3 156 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 7a_100000046372_200025704644 [0,1,0,0,0,0|2,0,0]=3 157 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 34a_100011215586_200025704644 [0,1,0,0,0,0|0,0,0]=1 158 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 7a_100011215586_200025704644 [0,1,0,0,0,0|0,0,0]=1 159 B13R2.57 [13CH3]Oc1ccc2nccnc2c1 34a_100000694412_200025704644 [0,1,0,0,0,0|1,0,0]=2 160 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,1,0,0,0,0|2,0,0]=3 161 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [0,1,0,0,0,0|2,0,0]=3 163 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [0,1,0,0,0,0|2,0,0]=3 164 B13R2.57 [13CH3]Sc1cc2nccnc2cn1 62a_100010370699_200025704644 [0,1,0,0,0,0|2,0,0]=3 165 B13R2.57 [13CH3]Sc1cc2nccnc2cn1 62a_200025704644_100010370699 [0,1,0,0,0,0|2,0,0]=3 166 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [0,1,0,0,0,0|1,0,0]=2 167 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_100011291633_200025704644 [0,1,0,0,0,0|2,0,0]=3 168 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_200025704644_100011291633 [0,1,0,0,0,0|2,0,0]=3 169 B13R2.57 [13CH3]Sc1ccc2cccnc2c1 62a_200025704644_100009816655 [0,1,0,0,0,0|2,0,0]=3 170 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_100000075685_200025704644 [0,1,0,0,0,0|3,0,0]=4 171 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_200025704644_100000075685 [0,1,0,0,0,0|3,0,0]=4 172 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_100000686496_200025704644 [0,1,0,0,0,0|2,0,0]=3 173 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_200025704644_100000686496 [0,1,0,0,0,0|2,0,0]=3 174 B13R2.57 [13CH3]Sc1ccc2ccncc2n1 62a_200025704644_100000020162 [0,1,0,0,0,0|3,0,0]=4 175 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_100009816743_200025704644 [0,1,0,0,0,0|2,0,0]=3 176 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_200025704644_100009816743 [0,1,0,0,0,0|2,0,0]=3 177 B13R2.57 [13CH3]Sc1ccc2cncnc2c1 62a_100010185614_200025704644 [0,1,0,0,0,0|3,0,0]=4 178 B13R2.57 [13CH3]Sc1ccc2cncnc2c1 62a_200025704644_100010185614 [0,1,0,0,0,0|3,0,0]=4 179 B13R2.57 [13CH3]Sc1ccc2cnncc2c1 62a_100010198781_200025704644 [0,1,0,0,0,0|3,0,0]=4 180 B13R2.57 [13CH3]Sc1ccc2cnncc2c1 62a_200025704644_100010198781 [0,1,0,0,0,0|3,0,0]=4 181 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_100011215947_200025704644 [0,1,0,0,0,0|0,0,0]=1 182 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_200025704644_100011215947 [0,1,0,0,0,0|0,0,0]=1 183 B13R2.57 [13CH3]Sc1ccc2ncccc2n1 62a_200025704644_100000073381 [0,1,0,0,0,0|1,0,0]=2 184 B13R2.57 [13CH3]Sc1ccc2nccnc2c1 62a_100011219451_200025704644 [0,1,0,0,0,0|1,0,0]=2 185 B13R2.57 [13CH3]Sc1ccc2nccnc2c1 62a_200025704644_100011219451 [0,1,0,0,0,0|1,0,0]=2 186 B13R2.57 [13CH3]Sc1ccc2nccnc2n1 62a_100012351543_200025704644 [0,1,0,0,0,0|2,0,0]=3 187 B13R2.57 [13CH3]Sc1ccc2nccnc2n1 62a_200025704644_100012351543 [0,1,0,0,0,0|2,0,0]=3 188 B13R2.57 [13CH3]Sc1ccc2ncncc2c1 62a_100009989443_200025704644 [0,1,0,0,0,0|1,0,0]=2 189 B13R2.57 [13CH3]Sc1ccc2ncncc2c1 62a_200025704644_100009989443 [0,1,0,0,0,0|1,0,0]=2 190 B13R2.57 [13CH3]Sc1ccc2nnccc2c1 62a_100010209549_200025704644 [0,1,0,0,0,0|1,0,0]=2 191 B13R2.57 [13CH3]Sc1ccc2nnccc2c1 62a_200025704644_100010209549 [0,1,0,0,0,0|1,0,0]=2 192 B13R2.57 [13CH3]Sc1cnc2ccccc2c1 62a_200025704644_100000737414 [0,1,0,0,0,0|2,0,0]=3 193 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_100000756483_200025704644 [0,1,0,0,0,0|3,0,0]=4 194 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_200025704644_100000756483 [0,1,0,0,0,0|3,0,0]=4 195 B13R2.57 [13CH3]Sc1cnc2cccnc2c1 62a_100010246316_200025704644 [0,1,0,0,0,0|3,0,0]=4 196 B13R2.57 [13CH3]Sc1cnc2cccnc2c1 62a_200025704644_100010246316 [0,1,0,0,0,0|3,0,0]=4 197 B13R2.57 [13CH3]Sc1cnc2ncccc2n1 62a_100000084304_200025704644 [0,1,0,0,0,0|2,0,0]=3 198 B13R2.57 [13CH3]Sc1cnc2ncccc2n1 62a_200025704644_100000084304 [0,1,0,0,0,0|2,0,0]=3 199 B13R2.57 [13CH3]Sc1cnc2nccnc2c1 62a_100000753224_200025704644 [0,1,0,0,0,0|2,0,0]=3 200 B13R2.57 [13CH3]Sc1cnc2nccnc2c1 62a_200025704644_100000753224 [0,1,0,0,0,0|2,0,0]=3 201 B13R2.57 [13CH3]Sc1ncc2ccccc2n1 62a_200025704644_100000097389 [0,1,0,0,0,0|3,0,0]=4 202 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [0,1,0,0,0,0|2,0,0]=3 203 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [0,1,0,0,0,0|0,0,0]=1 204 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [0,1,0,0,0,0|1,0,0]=2 205 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [0,1,0,0,0,0|3,0,0]=4 206 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [0,1,0,0,0,0|3,0,0]=4 207 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [0,1,0,0,0,0|2,0,0]=3 208 B13R2.155 Nc1ccc2ccc(cc2n1)O 271570a_203496583355_100010187616 [0,1,0,0,0,0|3,0,0]=4 209 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [0,1,0,0,0,0|1,0,0]=2 210 B13R2.155 Nc1cnc2ccc(cc2n1)O 271570a_203496583355_100010090528 [0,1,0,0,0,0|2,0,0]=3 211 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [0,1,0,0,0,0|3,0,0]=4 212 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [0,1,0,0,0,0|3,0,0]=4 213 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [0,1,0,0,0,0|2,0,0]=3 214 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [0,1,0,0,0,0|3,0,0]=4 215 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [0,1,0,0,0,0|3,0,0]=4 216 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [0,1,0,0,0,0|3,0,0]=4 217 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [0,1,0,0,0,0|3,0,0]=4 218 B13R2.155 Oc1ccc2ncc(cc2c1)Br 271570a_203496583355_200010254249 [0,1,0,0,0,0|1,0,0]=2 219 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [0,1,0,0,0,0|1,0,0]=2 220 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [0,1,0,0,0,0|1,0,0]=2 221 B13R2.155 Oc1ccc2ncc(cc2n1)F 271570a_203496583355_100009889179 [0,1,0,0,0,0|2,0,0]=3 222 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [0,1,0,0,0,0|2,0,0]=3 223 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [0,1,0,0,0,0|2,0,0]=3 224 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [0,1,0,0,0,0|1,0,0]=2 225 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [0,1,0,0,0,0|1,0,0]=2 226 B13R2.155 Oc1cnc2ccc(nc2c1)O 271570a_203496583355_100010009477 [0,1,0,0,0,0|2,0,0]=3 227 B13R2.155 [O-][n+]1ccc2ccc(cc2c1)O 271570a_203496583355_100009816120 [0,1,0,0,0,0|3,0,0]=4 228 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,1,0,0,0,0|2,0,0]=3 229 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [0,1,0,0,0,0|2,0,0]=3 230 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [0,1,0,0,0,0|0,0,0]=1 231 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [0,1,0,0,0,0|1,0,0]=2 232 B13R2.162 Cc1ccc2ncnc(c2c1)O 271570a_203496583355_100000743341 [0,1,0,0,0,0|1,0,0]=2 233 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,0|2,0,0]=3 234 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,0|3,0,0]=4 235 B13R2.162 Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100009817033 [0,1,0,0,0,0|1,0,0]=2 236 B13R2.162 Cc1nccc2c1cc(cc2)O 271570a_203496583355_200010739692 [0,1,0,0,0,0|3,0,0]=4 237 B13R2.162 Cc1ncnc2c1cc(cc2)O 271570a_203496583355_100000700471 [0,1,0,0,0,0|2,0,0]=3 238 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [0,1,0,0,0,0|3,0,0]=4 239 B13R2.162 Nc1ccc2nccc(c2c1)O 271570a_203496583355_100009879071 [0,1,0,0,0,0|1,0,0]=2 240 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,0|2,0,0]=3 241 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,0|3,0,0]=4 242 B13R2.162 Nc1ccnc2c1cc(cc2)O 271570a_203496583355_100011620571 [0,1,0,0,0,0|1,0,0]=2 243 B13R2.162 Nc1nccc2c1cc(cc2)O 271570a_203496583355_100012352255 [0,1,0,0,0,0|3,0,0]=4 244 B13R2.162 Nc1ncnc2c1cc(cc2)O 271570a_203496583355_100011390335 [0,1,0,0,0,0|2,0,0]=3 245 B13R2.162 Nc1ncnc2c1nc(cc2)O 271570a_203496583355_100011016601 [0,1,0,0,0,0|3,0,0]=4 246 B13R2.162 O=c1[nH]cnc2c1cc(cc2)O 271570a_203496583355_100000755678 [0,1,0,0,0,0|2,0,0]=3 247 B13R2.162 O=c1[nH]cnc2c1cc(cn2)O 271570a_203496583355_100010182796 [0,1,0,0,0,0|3,0,0]=4 248 B13R2.162 O=c1[nH]cnc2c1cc(nc2)O 271570a_203496583355_100000101234 [0,1,0,0,0,0|3,0,0]=4 249 B13R2.162 O=c1[nH]cnc2c1nc(cc2)O 271570a_203496583355_100000117605 [0,1,0,0,0,0|3,0,0]=4 250 B13R2.162 O=c1cc[nH]c2c1cc(cc2)O 271570a_203496583355_100000746092 [0,1,0,0,0,0|1,0,1]=3 251 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,0|3,0,0]=4 252 B13R2.162 O=c1ccnc2n1cc(cc2)O 271570a_203496583355_100010178973 [0,1,0,0,0,0|2,0,0]=3 253 B13R2.162 O=c1ccnc2n1nc(cc2)O 271570a_203496583355_100000086298 [0,1,0,0,0,0|3,0,0]=4 254 B13R2.162 O=c1ccoc2c1cc(cc2)O 271570a_203496583355_100009813387 [0,1,0,0,0,0|2,0,0]=3 255 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,0|2,0,0]=3 256 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,0|2,0,0]=3 257 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,0|3,0,0]=4 258 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,0|3,0,0]=4 259 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_100000010956 [0,1,0,0,0,0|3,0,0]=4 260 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_200009844553 [0,1,0,0,0,0|3,0,0]=4 261 B13R2.162 Oc1ccc2cncc(c2c1)O 271570a_203496583355_100010136424 [0,1,0,0,0,0|3,0,0]=4 262 B13R2.162 Oc1ccc2nccc(c2c1)Cl 271570a_203496583355_100011310491 [0,1,0,0,0,0|1,0,0]=2 263 B13R2.162 Oc1ccc2nccc(c2c1)O 271570a_203496583355_100000075933 [0,1,0,0,0,0|1,0,0]=2 264 B13R2.162 Oc1ccc2ncnc(c2c1)Cl 271570a_203496583355_100000757566 [0,1,0,0,0,0|2,0,0]=3 265 B13R2.162 Oc1ccc2nncc(c2c1)O 271570a_203496583355_100010074700 [0,1,0,0,0,0|2,0,0]=3 266 B13R2.162 Oc1ccnc2c1cc(cc2)Br 271570a_203496583355_100010189052 [0,1,0,0,0,0|1,0,0]=2 267 B13R2.162 Oc1ccnc2c1cc(cc2)F 271570a_203496583355_100011217270 [0,1,0,0,0,0|1,0,0]=2 268 B13R2.162 Oc1ccnc2c1nc(cc2)F 271570a_203496583355_100000719316 [0,1,0,0,0,0|2,0,0]=3 269 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,0|3,0,0]=4 270 B13R2.162 Oc1nccc2c1cc(cc2)F 271570a_203496583355_100010202866 [0,1,0,0,0,0|3,0,0]=4 271 B13R2.162 Oc1ncnc2c1cc(cc2)F 271570a_203496583355_100000743340 [0,1,0,0,0,0|2,0,0]=3 272 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [0,1,0,0,0,0|2,0,0]=3 273 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [0,1,0,0,0,0|3,0,0]=4 274 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [0,1,0,0,0,0|0,0,0]=1 275 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [0,1,0,0,0,0|1,0,0]=2 276 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [0,1,0,0,0,0|2,0,0]=3 277 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,0|3,0,0]=4 278 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,0,0,0|2,0,0]=3 279 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [0,1,0,0,0,0|3,0,0]=4 280 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [0,1,0,0,0,0|2,0,0]=3 281 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,0|2,0,0]=3 282 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [0,1,0,0,0,0|3,0,0]=4 283 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [0,1,0,0,0,0|1,0,0]=2 284 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [0,1,0,0,0,0|3,0,0]=4 285 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [0,1,0,0,0,0|3,0,0]=4 286 B13R2.328 Nc1cc2cccnc2c(n1)O 271570a_203496583355_100010205410 [0,1,0,0,0,0|2,0,0]=3 287 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [0,1,0,0,0,0|3,0,0]=4 288 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,0|3,0,0]=4 289 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,0|3,0,0]=4 290 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,0|2,0,0]=3 291 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,0|2,0,0]=3 292 B13R2.328 Oc1cc(c2cnccc2c1)F 271570a_203496583355_100011068762 [0,1,0,0,0,0|3,0,0]=4 293 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [0,1,0,0,0,0|3,0,0]=4 294 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [0,1,0,0,0,0|1,0,0]=2 295 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [0,1,0,0,0,0|1,0,0]=2 296 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [0,1,0,0,0,0|1,0,0]=2 297 B13R2.328 Oc1cc(c2nccnc2c1)F 271570a_203496583355_100010079260 [0,1,0,0,0,0|2,0,0]=3 298 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [0,1,0,0,0,0|1,0,0]=2 299 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [0,1,0,0,0,0|1,0,0]=2 300 B13R2.328 Oc1cc(cc2c1nccn2)F 271570a_203496583355_100011083936 [0,1,0,0,0,0|2,0,0]=3 301 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [0,1,0,0,0,0|3,0,0]=4 302 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [0,1,0,0,0,0|3,0,0]=4 303 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,1,0,0,0,0|2,0,0]=3 304 B13R2.369 Cc1cc2cccnc2nc1O 271570a_203496583355_100009877248 [0,1,0,0,0,0|1,0,0]=2 305 B13R2.369 Cc1cc2ncccc2cc1O 271570a_203496583355_100010137429 [0,1,0,0,0,0|1,0,0]=2 306 B13R2.369 Cc1cc2nccnc2cc1O 271570a_203496583355_100010080479 [0,1,0,0,0,0|1,0,0]=2 307 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [0,1,0,0,0,0|3,0,0]=4 308 B13R2.369 Cc1nc2nccnc2cc1O 271570a_203496583355_100010212747 [0,1,0,0,0,0|2,0,0]=3 309 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [0,1,0,0,0,0|2,0,0]=3 310 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [0,1,0,0,0,0|3,0,0]=4 311 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,1,0,0,0,0|3,0,0]=4 312 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [0,1,0,0,0,0|2,0,0]=3 313 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [0,1,0,0,0,0|2,0,0]=3 314 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [0,1,0,0,0,0|2,0,0]=3 315 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [0,1,0,0,0,0|3,0,0]=4 316 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [0,1,0,0,0,0|3,0,0]=4 317 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [0,1,0,0,0,0|3,0,0]=4 318 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [0,1,0,0,0,0|3,0,0]=4 319 B13R2.369 Oc1cc2cccnc2cc1F 271570a_203496583355_100009854028 [0,1,0,0,0,0|1,0,0]=2 320 B13R2.369 Oc1cc2cccnc2cc1O 271570a_203496583355_200010153759 [0,1,0,0,0,0|1,0,0]=2 321 B13R2.369 Oc1cc2ccncc2cc1F 271570a_203496583355_100011105921 [0,1,0,0,0,0|3,0,0]=4 322 B13R2.369 Oc1cc2cnccc2cc1F 271570a_203496583355_100010244713 [0,1,0,0,0,0|3,0,0]=4 323 B13R2.369 Oc1cc2nccnc2cc1F 271570a_203496583355_100010080477 [0,1,0,0,0,0|2,0,0]=3 324 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [0,1,0,0,0,0|3,0,0]=4 325 B13R2.3683 C[n+]1ccc2cc(ccc2c1)O 271570a_203496583355_100015191232 [0,1,0,0,0,0|2,0,0]=3 326 B13R2.3683 Cc1ccc2cc(ccc2n1)O 271570a_203496583355_100000686635 [0,1,0,0,0,0|1,0,0]=2 327 B13R2.3683 Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100011865911 [0,1,0,0,0,0|0,0,0]=1 328 B13R2.3683 Cc1ccc2nc(ccc2n1)O 271570a_203496583355_200009884078 [0,1,0,0,0,0|1,0,0]=2 329 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [0,1,0,0,0,0|2,0,0]=3 330 B13R2.3683 Nc1cc2ccc(cc2cn1)O 271570a_203496583355_100010232990 [0,1,0,0,0,0|3,0,0]=4 331 B13R2.3683 Nc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185457 [0,1,0,0,0,0|2,0,0]=3 332 B13R2.3683 Nc1ccc2cc(ccc2n1)O 271570a_203496583355_100011934619 [0,1,0,0,0,0|1,0,0]=2 333 B13R2.3683 Nc1ccc2cc(cnc2c1)O 271570a_203496583355_200010264087 [0,1,0,0,0,0|3,0,0]=4 334 B13R2.3683 Nc1ccc2cc(cnc2n1)O 271570a_203496583355_100010214896 [0,1,0,0,0,0|2,0,0]=3 335 B13R2.3683 Nc1ccc2nc(cnc2c1)O 271570a_203496583355_100009885871 [0,1,0,0,0,0|2,0,0]=3 336 B13R2.3683 Nc1cnc2cc(ccc2c1)O 271570a_203496583355_100010142226 [0,1,0,0,0,0|3,0,0]=4 337 B13R2.3683 Nc1ncc2cc(ccc2n1)O 271570a_203496583355_100010138702 [0,1,0,0,0,0|2,0,0]=3 338 B13R2.3683 Nc1ncc2cc(cnc2n1)O 271570a_203496583355_200010063650 [0,1,0,0,0,0|3,0,0]=4 339 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,1,0,0,0,0|1,0,1]=3 340 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,1,0,0,0,0|2,0,0]=3 341 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,1,0,0,0,0|2,0,1]=4 342 B13R2.3683 Oc1ccc2cc(ccc2c1)Br 271570a_203496583355_100012344972 [0,1,0,0,0,0|2,0,0]=3 343 B13R2.3683 Oc1ccc2cc(ccc2c1)F 271570a_203496583355_100009817052 [0,1,0,0,0,0|2,0,0]=3 344 B13R2.3683 Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185455 [0,1,0,0,0,0|2,0,0]=3 345 B13R2.3683 Oc1ccc2cc(ccc2n1)F 271570a_203496583355_100011998705 [0,1,0,0,0,0|1,0,0]=2 346 B13R2.3683 Oc1ccc2cc(cnc2c1)Br 271570a_203496583355_200015509644 [0,1,0,0,0,0|3,0,0]=4 347 B13R2.3683 Oc1ccc2cc(cnc2c1)F 271570a_203496583355_100010751466 [0,1,0,0,0,0|3,0,0]=4 348 B13R2.3683 Oc1ccc2nc(ccc2c1)Cl 271570a_203496583355_200012034268 [0,1,0,0,0,0|1,0,0]=2 349 B13R2.3683 Oc1ccc2nc(ccc2c1)O 271570a_203496583355_100009849208 [0,1,0,0,0,0|1,0,0]=2 350 B13R2.3683 Oc1ccc2nc(cnc2c1)O 271570a_203496583355_200010664160 [0,1,0,0,0,0|2,0,0]=3 351 B13R2.3683 Oc1cnc2cc(ccc2c1)Cl 271570a_203496583355_100015716233 [0,1,0,0,0,0|3,0,0]=4 352 B13R2.3683 Oc1cnc2cc(ccc2c1)O 271570a_203496583355_200010153753 [0,1,0,0,0,0|3,0,0]=4 353 B13R2.3683 Oc1cnc2cc(ccc2n1)F 271570a_203496583355_100000098432 [0,1,0,0,0,0|2,0,0]=3 354 B13R2.3683 Oc1cnc2nc(ccc2c1)O 271570a_203496583355_100009814606 [0,1,0,0,0,0|2,0,0]=3 355 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,0,0,0|2,0,0]=3 356 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [0,1,0,0,0,0|2,0,0]=3 357 B13R2.5179 Cc1ccc2c(ncnc2c1)O 271570a_203496583355_100000099684 [0,1,0,0,0,0|3,0,0]=4 358 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,0|3,0,0]=4 359 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [0,1,0,0,0,0|3,0,0]=4 360 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [0,1,0,0,0,0|3,0,0]=4 361 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [0,1,0,0,0,0|3,0,0]=4 362 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,0|2,0,0]=3 363 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,0|3,0,0]=4 364 B13R2.5179 Nc1ccnc2c1ccc(c2)O 271570a_203496583355_200009816820 [0,1,0,0,0,0|3,0,0]=4 365 B13R2.5179 Nc1nccc2c1ccc(c2)O 271570a_203496583355_100000732483 [0,1,0,0,0,0|3,0,0]=4 366 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,0|3,0,0]=4 367 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [0,1,0,0,0,0|3,0,0]=4 368 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,1,0,0,0,0|3,0,0]=4 369 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,0|2,0,0]=3 370 B13R2.5179 Oc1ccc2c(ccnc2c1)Cl 271570a_203496583355_100009996786 [0,1,0,0,0,0|3,0,0]=4 371 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045489 [0,1,0,0,0,0|3,0,0]=4 372 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000756855 [0,1,0,0,0,0|3,0,0]=4 373 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100000760485 [0,1,0,0,0,0|3,0,0]=4 374 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100009867704 [0,1,0,0,0,0|3,0,0]=4 375 B13R2.5179 Oc1ccnc2c1ccc(c2)Cl 271570a_203496583355_100012352046 [0,1,0,0,0,0|3,0,0]=4 376 B13R2.5179 Oc1ccnc2c1ccc(c2)F 271570a_203496583355_100000755548 [0,1,0,0,0,0|3,0,0]=4 377 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,0|3,0,0]=4 378 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,0|3,0,0]=4 379 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,0|3,0,0]=4 380 B13R2.5179 Oc1nccc2c1ccc(c2)F 271570a_203496583355_100000097391 [0,1,0,0,0,0|3,0,0]=4 381 B13R2.5179 [O-][n+]1ccc2c(cccc2c1)O 271570a_203496583355_200010126733 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.1 C=CCNc1ccc(cc1)Br 2230a_100000210018_100000210623 [0,0,1,0,0,0|1,0,2]=4 383 B11R1.1 C=CCNc1ccc(cc1)Br 34a_100000210018_100015514636 [0,0,1,0,0,0|1,0,2]=4 384 B11R1.1 C=CCNc1ccc(cc1)C 34a_100000124888_100015514636 [0,0,1,0,0,0|0,0,2]=3 385 B11R1.1 C=CCNc1ccc(cc1)Cl 2230a_100000210052_100000210623 [0,0,1,0,0,0|1,0,2]=4 386 B11R1.1 C=CCNc1ccc(cc1)Cl 34a_100000210052_100015514636 [0,0,1,0,0,0|1,0,2]=4 387 B11R1.1 C=CCNc1ccc(cc1)F 34a_100000185862_100015514636 [0,0,1,0,0,0|1,0,2]=4 388 B11R1.1 C=CCNc1ccc(cc1)I 34a_100000185761_100015514636 [0,0,1,0,0,0|1,0,2]=4 389 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [0,0,1,0,0,0|1,0,2]=4 390 B11R1.1 C=CCOc1ccc(cc1)Br 34a_100000185759_100015514636 [0,0,1,0,0,0|2,0,1]=4 391 B11R1.1 C=CCOc1ccc(cc1)Br 7a_100000185759_100015514636 [0,0,1,0,0,0|2,0,1]=4 392 B11R1.1 C=CCOc1ccc(cc1)C 34a_100000210336_100015514636 [0,0,1,0,0,0|1,0,1]=3 393 B11R1.1 C=CCOc1ccc(cc1)C 7a_100000210336_100015514636 [0,0,1,0,0,0|1,0,1]=3 394 B11R1.1 C=CCOc1ccc(cc1)Cl 34a_100000210216_100015514636 [0,0,1,0,0,0|2,0,1]=4 395 B11R1.1 C=CCOc1ccc(cc1)Cl 7a_100000210216_100015514636 [0,0,1,0,0,0|2,0,1]=4 396 B11R1.1 C=CCOc1ccc(cc1)F 34a_100000210339_100015514636 [0,0,1,0,0,0|2,0,1]=4 397 B11R1.1 C=CCOc1ccc(cc1)I 34a_100000212066_100015514636 [0,0,1,0,0,0|2,0,1]=4 398 B11R1.1 C=CCOc1ccc(cc1)I 7a_100000212066_100015514636 [0,0,1,0,0,0|2,0,1]=4 399 B11R1.1 C=CCOc1ccc(cc1)N 34a_100000185829_100015514636 [0,0,1,0,0,0|2,0,1]=4 400 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [0,0,1,0,0,0|2,0,1]=4 401 B11R1.1 C=CCOc1ccc(cn1)C 34a_100000759353_100015514636 [0,0,1,0,0,0|2,0,1]=4 402 B11R1.1 C=CCOc1ccc(nc1)C 34a_100000745506_100015514636 [0,0,1,0,0,0|2,0,1]=4 403 B11R1.1 C=CCOc1ccc(nc1)C 7a_100000745506_100015514636 [0,0,1,0,0,0|2,0,1]=4 404 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000210623_100000752885 [0,0,1,0,0,0|2,0,1]=4 405 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000752885_100000210623 [0,0,1,0,0,0|2,0,1]=4 406 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000186775_100000210623 [0,0,1,0,0,0|1,0,1]=3 407 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000210623_100000186775 [0,0,1,0,0,0|1,0,1]=3 408 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000210623_100000755918 [0,0,1,0,0,0|2,0,1]=4 409 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000755918_100000210623 [0,0,1,0,0,0|2,0,1]=4 410 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000210623_100000211213 [0,0,1,0,0,0|2,0,1]=4 411 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000211213_100000210623 [0,0,1,0,0,0|2,0,1]=4 412 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000185761_100000210623 [0,0,1,0,0,0|2,0,1]=4 413 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000210623_100000185761 [0,0,1,0,0,0|2,0,1]=4 414 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [0,0,1,0,0,0|2,0,1]=4 415 B11R1.1 C=CCSc1ccc(cn1)C 62a_100000210623_100000754016 [0,0,1,0,0,0|2,0,1]=4 416 B11R1.1 C=CCSc1ccc(cn1)C 62a_100011192072_100000210623 [0,0,1,0,0,0|2,0,1]=4 417 B11R1.1 C=CCSc1ccc(nc1)C 62a_100000210623_100000751577 [0,0,1,0,0,0|2,0,1]=4 418 B11R1.1 C=CCSc1ccc(nc1)C 62a_100000751577_100000210623 [0,0,1,0,0,0|2,0,1]=4 419 B11R1.1 CC=NNc1ccc(cc1)C 4a_100000683527_200000210099 [0,0,1,0,0,0|1,0,2]=4 420 B11R1.1 Cc1ccc(cc1)NCC=O 34a_100000124888_200009817547 [0,0,1,0,0,0|1,0,2]=4 421 B11R1.1 Cc1ccc(cc1)OCC=O 34a_100000210336_200009817547 [0,0,1,0,0,0|2,0,1]=4 422 B11R1.1 Cc1ccc(cc1)OCC=O 7a_100000210336_200015260668 [0,0,1,0,0,0|2,0,1]=4 423 B11R1.1 Cc1ccc(cc1)SCC=O 62a_100000186775_200015260668 [0,0,1,0,0,0|2,0,1]=4 424 B11R1.1 Cc1ccc(cc1)SCC=O 62a_200015260668_100000186775 [0,0,1,0,0,0|2,0,1]=4 425 B11R1.17 CC=NNc1ncccc1Br 4a_100011464834_200000210099 [0,0,1,0,0,0|3,0,0]=4 426 B11R1.17 CC=NNc1ncccc1C 4a_100000708268_200000210099 [0,0,1,0,0,0|2,0,1]=4 427 B11R1.17 CC=NNc1ncccc1Cl 4a_100000741667_200000210099 [0,0,1,0,0,0|3,0,0]=4 428 B11R1.17 CC=NNc1ncccc1F 4a_100000717775_200000210099 [0,0,1,0,0,0|3,0,0]=4 429 B11R1.17 CC=NNc1ncccc1I 4a_100010221029_200000210099 [0,0,1,0,0,0|3,0,0]=4 430 B11R1.24 C=CCNc1cccc(c1)C 2230a_100000188690_100000210623 [0,0,1,0,0,0|2,0,1]=4 431 B11R1.24 C=CCNc1cccc(c1)C 34a_100000188690_100015514636 [0,0,1,0,0,0|2,0,1]=4 432 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [0,0,1,0,0,0|2,0,1]=4 433 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [0,0,1,0,0,0|2,0,1]=4 434 B11R1.24 C=CCSc1cccc(c1)C 62a_100000210623_100011215228 [0,0,1,0,0,0|2,0,1]=4 435 B11R1.24 C=CCSc1cccc(c1)C 62a_100011215228_100000210623 [0,0,1,0,0,0|2,0,1]=4 436 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [0,0,1,0,0,0|3,0,0]=4 437 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [0,0,1,0,0,0|2,0,1]=4 438 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [0,0,1,0,0,0|2,0,1]=4 439 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [0,0,1,0,0,0|2,0,1]=4 440 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [0,0,1,0,0,0|2,0,1]=4 441 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [0,0,1,0,0,0|2,0,1]=4 442 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [0,0,1,0,0,0|2,0,1]=4 443 B11R1.37 C=Cc1cc(ccc1C#N)Br 271570a_100011290941_100010214477 [0,0,1,0,0,0|3,0,0]=4 444 B11R1.37 C=Cc1cc(ccc1C#N)C 271570a_100011290941_100000693804 [0,0,1,0,0,0|2,0,0]=3 445 B11R1.37 C=Cc1cc(ccc1C#N)Cl 271570a_100011290941_100012355178 [0,0,1,0,0,0|3,0,0]=4 446 B11R1.37 C=Cc1cc(ccc1C#N)F 271570a_100011290941_100000747196 [0,0,1,0,0,0|3,0,0]=4 447 B11R1.37 C=Cc1cc(ccc1C#N)N 271570a_100011290941_100000689153 [0,0,1,0,0,0|3,0,0]=4 448 B11R1.37 C=Cc1cc(ccc1C#N)O 271570a_100011290941_100012184851 [0,0,1,0,0,0|3,0,0]=4 449 B11R1.37 C=Cc1cc(ccc1C=O)Br 271570a_100011290941_100010146562 [0,0,1,0,0,0|3,0,0]=4 450 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [0,0,1,0,0,0|2,0,0]=3 451 B11R1.37 C=Cc1cc(ccc1C=O)F 271570a_100011290941_100000752949 [0,0,1,0,0,0|3,0,0]=4 452 B11R1.37 C=Cc1cc(ccc1C=O)O 271570a_100011290941_100011236494 [0,0,1,0,0,0|3,0,0]=4 453 B11R1.37 C=Cc1cc(ccc1CN)F 271570a_100011290941_100000708791 [0,0,1,0,0,0|3,0,0]=4 454 B11R1.37 C=Cc1cc(ccc1CO)Br 271570a_100011290941_100010146605 [0,0,1,0,0,0|3,0,0]=4 455 B11R1.37 C=Cc1cc(ccc1CO)Cl 271570a_100011290941_100000722340 [0,0,1,0,0,0|3,0,0]=4 456 B11R1.37 C=Cc1cc(ccc1CO)F 271570a_100011290941_100000744086 [0,0,1,0,0,0|3,0,0]=4 457 B11R1.37 C=Cc1cc(ccc1CO)O 271570a_100011290941_100010146404 [0,0,1,0,0,0|3,0,0]=4 458 B11R1.37 C=Cc1cc(ccc1NC)C 271570a_100011290941_100000221369 [0,0,1,0,0,0|0,0,2]=3 459 B11R1.37 C=Cc1cc(ccc1NC)F 271570a_100011290941_100011246292 [0,0,1,0,0,0|1,0,2]=4 460 B11R1.37 C=Cc1cc(ccc1NN)C 271570a_100011290941_100016996181 [0,0,1,0,0,0|1,0,1]=3 461 B11R1.37 C=Cc1cc(ccc1OC)Br 271570a_100011290941_100012351588 [0,0,1,0,0,0|2,0,1]=4 462 B11R1.37 C=Cc1cc(ccc1OC)C 271570a_100011290941_100000186399 [0,0,1,0,0,0|1,0,1]=3 463 B11R1.37 C=Cc1cc(ccc1OC)Cl 271570a_100011290941_100011215930 [0,0,1,0,0,0|2,0,1]=4 464 B11R1.37 C=Cc1cc(ccc1OC)F 271570a_100011290941_100000171694 [0,0,1,0,0,0|2,0,1]=4 465 B11R1.37 C=Cc1cc(ccc1OC)N 271570a_100011290941_100000187427 [0,0,1,0,0,0|2,0,1]=4 466 B11R1.37 C=Cc1cc(ccc1OC)O 271570a_100011290941_100010084122 [0,0,1,0,0,0|2,0,1]=4 467 B11R1.37 C=Cc1cc(ccc1SC)C 271570a_100011290941_200010201864 [0,0,1,0,0,0|1,0,1]=3 468 B11R1.37 C=Cc1cc(ccc1SC)F 271570a_100011290941_100009817003 [0,0,1,0,0,0|2,0,1]=4 469 B11R1.37 C=Cc1cc(ccc1SC)F 62a_100012356183_200000210301 [0,0,1,0,0,0|2,0,1]=4 470 B11R1.37 C=Cc1cc(ccc1SC)F 62a_200000210301_100012356183 [0,0,1,0,0,0|2,0,1]=4 471 B11R1.37 C=Cc1cc(ccc1S[13CH3])F 62a_100012356183_200025704644 [0,0,1,0,0,0|2,0,1]=4 472 B11R1.37 C=Cc1cc(ccc1S[13CH3])F 62a_200025704644_100012356183 [0,0,1,0,0,0|2,0,1]=4 473 B11R1.37 C=Cc1cc(cnc1C#N)C 271570a_100011290941_100009874213 [0,0,1,0,0,0|3,0,0]=4 474 B11R1.37 C=Cc1cc(cnc1NN)C 271570a_100011290941_100012357580 [0,0,1,0,0,0|2,0,1]=4 475 B11R1.37 C=Cc1cc(cnc1OC)C 271570a_100011290941_100012353929 [0,0,1,0,0,0|2,0,1]=4 476 B11R1.37 C=Cc1cc(ncc1CC)C 271570a_100011290941_100010291839 [0,0,1,0,0,0|2,0,1]=4 477 B11R1.37 C=Cc1cc(ncc1OC)C 271570a_100011290941_100010109759 [0,0,1,0,0,0|2,0,1]=4 478 B11R1.37 C=Cc1ccc(cc1C#N)C 271570a_100011290941_100011935190 [0,0,1,0,0,0|2,0,1]=4 479 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [0,0,1,0,0,0|3,0,0]=4 480 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [0,0,1,0,0,0|2,0,0]=3 481 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [0,0,1,0,0,0|3,0,0]=4 482 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [0,0,1,0,0,0|3,0,0]=4 483 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [0,0,1,0,0,0|3,0,0]=4 484 B11R1.37 C=Cc1ccc(cc1CO)C 271570a_100011290941_100012361352 [0,0,1,0,0,0|2,0,1]=4 485 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [0,0,1,0,0,0|2,0,1]=4 486 B11R1.37 C=Cc1ccc(cc1SC)C 271570a_100011290941_200010709736 [0,0,1,0,0,0|2,0,1]=4 487 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [0,0,1,0,0,0|3,0,0]=4 488 B11R1.37 C=Cc1nc(ccc1C#N)C 271570a_100011290941_100000741175 [0,0,1,0,0,0|3,0,0]=4 489 B11R1.37 C=Cc1nc(ccc1C=O)C 271570a_100011290941_100000085379 [0,0,1,0,0,0|3,0,0]=4 490 B11R1.37 C=Cc1nc(ccc1CO)C 271570a_100011290941_102495338573 [0,0,1,0,0,0|3,0,0]=4 491 B11R1.37 C=Cc1nc(ccc1OC)C 271570a_100011290941_100009820875 [0,0,1,0,0,0|2,0,1]=4 492 B11R1.37 C=Cc1ncc(cc1C=O)C 271570a_100011290941_100000050350 [0,0,1,0,0,0|3,0,0]=4 493 B11R1.37 CSc1ccc(cc1C=O)C 62a_100011551863_200000210301 [0,0,1,0,0,0|2,0,1]=4 494 B11R1.37 CSc1ccc(cc1C=O)C 62a_200000210301_100011551863 [0,0,1,0,0,0|2,0,1]=4 495 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_100011551863_200025704644 [0,0,1,0,0,0|2,0,1]=4 496 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100011551863 [0,0,1,0,0,0|2,0,1]=4 497 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,0,1,0,0,0|2,0,1]=4 498 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [0,0,1,0,0,0|1,0,1]=3 499 B11R1.40 C=CC(=O)Cc1cccnn1 1458a_100000185746_100016990269 [0,0,1,0,0,0|2,0,1]=4 500 B11R1.40 C=CC(=O)Cc1cnccn1 1458a_100000185746_100016995436 [0,0,1,0,0,0|2,0,1]=4 501 B11R1.40 C=CC(=O)Cc1cncnc1 1458a_100000185746_100015196519 [0,0,1,0,0,0|2,0,1]=4 502 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,0,1,0,0,0|3,0,0]=4 503 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,0,1,0,0,0|3,0,0]=4 504 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [0,0,1,0,0,0|2,0,1]=4 505 B11R1.40 C=CC(C)Sc1cccnc1 62a_100011215867_100000210063 [0,0,1,0,0,0|1,0,1]=3 506 B11R1.40 C=CC(C)Sc1cccnn1 62a_100011215867_100016991348 [0,0,1,0,0,0|2,0,1]=4 507 B11R1.40 C=CC(C)Sc1ccnnc1 62a_100011215867_100000732662 [0,0,1,0,0,0|2,0,1]=4 508 B11R1.40 C=CC(C)Sc1cnccn1 62a_100011215867_100000211759 [0,0,1,0,0,0|2,0,1]=4 509 B11R1.40 C=CC(C)Sc1cncnc1 62a_100011215867_100011206942 [0,0,1,0,0,0|2,0,1]=4 510 B11R1.40 CC(=Cc1cncnc1)C#N 6a_100000749868_200000212204 [0,0,1,0,0,0|2,0,1]=4 511 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,0,1,0,0,0|2,0,1]=4 512 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,0,1,0,0,0|2,0,1]=4 513 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,0,1,0,0,0|2,0,1]=4 514 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,0,1,0,0,0|2,0,1]=4 515 B11R1.41 C=C=Cc1cccnc1C=O 271570a_100015277604_100011934733 [0,0,1,0,0,0|1,0,2]=4 516 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,0,1,0,0,0|1,0,2]=4 517 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,0,1,0,0,0|2,0,1]=4 518 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,0,1,0,0,0|2,0,1]=4 519 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,0,1,0,0,0|2,0,1]=4 520 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,0,1,0,0,0|2,0,1]=4 521 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,0,1,0,0,0|2,0,1]=4 522 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,0,1,0,0,0|2,0,1]=4 523 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,0,1,0,0,0|2,0,1]=4 524 B11R1.41 C=Cc1ccccc1NCC 271570a_100011290941_114873767003 [0,0,1,0,0,0|2,0,1]=4 525 B11R1.41 C=Cc1ccccc1NCC 34a_100012022501_100000210202 [0,0,1,0,0,0|2,0,1]=4 526 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,0,1,0,0,0|2,0,1]=4 527 B11R1.41 C=Cc1ccccc1SCC 271570a_100011290941_100000230856 [0,0,1,0,0,0|2,0,1]=4 528 B11R1.41 C=Cc1ccccc1SCC 62a_100000210202_100011218376 [0,0,1,0,0,0|2,0,1]=4 529 B11R1.41 C=Cc1ccccc1SCC 62a_100011218376_100000210202 [0,0,1,0,0,0|2,0,1]=4 530 B11R1.41 C=Cc1ncccc1CC#N 271570a_100011290941_100000096391 [0,0,1,0,0,0|1,0,2]=4 531 B11R1.41 C=Cc1ncccc1CNC 271570a_100011290941_103496529121 [0,0,1,0,0,0|1,0,1]=3 532 B11R1.41 C=Cc1ncccc1OCC 271570a_100011290941_100011597540 [0,0,1,0,0,0|1,0,1]=3 533 B11R1.41 C=Cc1nccnc1OCC 271570a_100011290941_200010128176 [0,0,1,0,0,0|2,0,1]=4 534 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [0,0,1,0,0,0|2,0,1]=4 535 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,0,1,0,0,0|2,0,0]=3 536 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [0,0,1,0,0,0|1,0,2]=4 537 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,0,1,0,0,0|2,0,1]=4 538 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,0,1,0,0,0|2,0,1]=4 539 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [0,0,1,0,0,0|2,0,1]=4 540 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [0,0,1,0,0,0|3,0,0]=4 541 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,0,1,0,0,0|2,0,1]=4 542 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [0,0,1,0,0,0|2,0,1]=4 543 B11R1.41 CC=Cc1cccnc1C#N 271570a_100016259895_100000685805 [0,0,1,0,0,0|1,0,1]=3 544 B11R1.41 CC=Cc1cccnc1C=O 271570a_100016259895_100011934733 [0,0,1,0,0,0|1,0,0]=2 545 B11R1.41 CC=Cc1cccnc1CC 271570a_100016259895_100009877225 [0,0,1,0,0,0|0,0,2]=3 546 B11R1.41 CC=Cc1cccnc1CN 271570a_100016259895_100020591323 [0,0,1,0,0,0|1,0,1]=3 547 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,0,1,0,0,0|1,0,1]=3 548 B11R1.41 CC=Cc1cccnc1NC 271570a_100016259895_100000700899 [0,0,1,0,0,0|1,0,1]=3 549 B11R1.41 CC=Cc1cccnc1NN 271570a_100016259895_100011464834 [0,0,1,0,0,0|2,0,0]=3 550 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,0,1,0,0,0|1,0,1]=3 551 B11R1.41 CC=Cc1cccnc1SC 271570a_100016259895_100011465278 [0,0,1,0,0,0|1,0,1]=3 552 B11R1.41 CC=Cc1ccncc1C=O 271570a_100016259895_100000050567 [0,0,1,0,0,0|3,0,0]=4 553 B11R1.41 CC=Cc1cnccc1C=O 271570a_100016259895_100011934409 [0,0,1,0,0,0|3,0,0]=4 554 B11R1.41 CC=Cc1cncnc1C#N 271570a_100016259895_100012001395 [0,0,1,0,0,0|2,0,1]=4 555 B11R1.41 CC=Cc1cncnc1CC 271570a_100016259895_100009816992 [0,0,1,0,0,0|1,0,2]=4 556 B11R1.41 CC=Cc1cncnc1NC 271570a_100016259895_200012180720 [0,0,1,0,0,0|2,0,1]=4 557 B11R1.41 CC=Cc1cncnc1OC 271570a_100016259895_100000719902 [0,0,1,0,0,0|2,0,1]=4 558 B11R1.41 CC=Cc1ncccc1C=O 271570a_100016259895_100009816751 [0,0,1,0,0,0|3,0,0]=4 559 B11R1.41 CC=Cc1nccnc1C#N 271570a_100016259895_100000040484 [0,0,1,0,0,0|2,0,1]=4 560 B11R1.41 CC=Cc1nccnc1CC 271570a_100016259895_100011995844 [0,0,1,0,0,0|1,0,2]=4 561 B11R1.41 CC=Cc1nccnc1CN 271570a_100016259895_100000729963 [0,0,1,0,0,0|2,0,1]=4 562 B11R1.41 CC=Cc1nccnc1CO 271570a_100016259895_100000057004 [0,0,1,0,0,0|2,0,1]=4 563 B11R1.41 CC=Cc1nccnc1NC 271570a_100016259895_100011529439 [0,0,1,0,0,0|2,0,1]=4 564 B11R1.41 CC=Cc1nccnc1NN 271570a_100016259895_100000755098 [0,0,1,0,0,0|3,0,0]=4 565 B11R1.41 CC=Cc1nccnc1OC 271570a_100016259895_100000749998 [0,0,1,0,0,0|2,0,1]=4 566 B11R1.41 CCSc1cccnc1C=O 62a_100000210202_100011934733 [0,0,1,0,0,0|2,0,1]=4 567 B11R1.41 CCSc1cccnc1C=O 62a_100011934733_100000210202 [0,0,1,0,0,0|2,0,1]=4 568 B11R1.81 C=C=Cc1ccc(cc1Br)C 271570a_100015277604_100009813563 [0,0,1,0,0,0|2,0,1]=4 569 B11R1.81 C=C=Cc1ccc(cc1C)C 271570a_100015277604_100011217332 [0,0,1,0,0,0|1,0,2]=4 570 B11R1.81 C=C=Cc1ccc(cc1Cl)C 271570a_100015277604_100011263221 [0,0,1,0,0,0|2,0,1]=4 571 B11R1.81 C=C=Cc1ccc(cc1F)C 271570a_100015277604_100011216119 [0,0,1,0,0,0|2,0,1]=4 572 B11R1.81 C=C=Cc1ccc(cc1N)C 271570a_100015277604_100011216686 [0,0,1,0,0,0|2,0,1]=4 573 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [0,0,1,0,0,0|2,0,1]=4 574 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,0,1,0,0,0|2,0,1]=4 575 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,0,1,0,0,0|1,0,2]=4 576 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,0,1,0,0,0|2,0,1]=4 577 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,0,1,0,0,0|2,0,1]=4 578 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,0,1,0,0,0|2,0,1]=4 579 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,0,1,0,0,0|2,0,1]=4 580 B11R1.86 CC(=Cc1ccc[nH]c1=O)C 271570a_100102525489_100000050042 [0,0,1,0,0,0|1,0,2]=4 581 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [0,0,1,0,0,0|2,0,1]=4 582 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,0,1,0,0,0|1,0,2]=4 583 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [0,0,1,0,0,0|2,0,1]=4 584 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [0,0,1,0,0,0|2,0,1]=4 585 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,0,1,0,0,0|2,0,1]=4 586 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,0,1,0,0,0|2,0,1]=4 587 B11R1.86 CC(=Cc1cccnc1Br)C 271570a_100102525489_100010202626 [0,0,1,0,0,0|1,0,1]=3 588 B11R1.86 CC(=Cc1cccnc1C)C 271570a_100102525489_100000751574 [0,0,1,0,0,0|0,0,2]=3 589 B11R1.86 CC(=Cc1cccnc1Cl)C 271570a_100102525489_100000036424 [0,0,1,0,0,0|1,0,1]=3 590 B11R1.86 CC(=Cc1cccnc1F)C 271570a_100102525489_100009816115 [0,0,1,0,0,0|1,0,1]=3 591 B11R1.86 CC(=Cc1cccnc1N)C 271570a_100102525489_100000045569 [0,0,1,0,0,0|1,0,1]=3 592 B11R1.86 CC(=Cc1cncnc1Br)C 271570a_100102525489_200012461658 [0,0,1,0,0,0|2,0,1]=4 593 B11R1.86 CC(=Cc1cncnc1C)C 271570a_100102525489_100009819671 [0,0,1,0,0,0|1,0,2]=4 594 B11R1.86 CC(=Cc1cncnc1Cl)C 271570a_100102525489_100000758962 [0,0,1,0,0,0|2,0,1]=4 595 B11R1.86 CC(=Cc1cncnc1N)C 271570a_100102525489_100011996079 [0,0,1,0,0,0|2,0,1]=4 596 B11R1.86 CC(=Cc1cncnc1O)C 271570a_100102525489_100000751107 [0,0,1,0,0,0|2,0,1]=4 597 B11R1.86 CC(=Cc1nccnc1C)C 271570a_100102525489_100011999405 [0,0,1,0,0,0|1,0,2]=4 598 B11R1.86 CC(=Cc1nccnc1F)C 271570a_100102525489_200010125657 [0,0,1,0,0,0|2,0,1]=4 599 B11R1.86 CC(=Cc1nccnc1N)C 271570a_100102525489_100000747729 [0,0,1,0,0,0|2,0,1]=4 600 B11R1.86 CC(=O)Cc1cccnc1Br 1458a_100000070787_100010140945 [0,0,1,0,0,0|2,0,1]=4 601 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [0,0,1,0,0,0|1,0,2]=4 602 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000070787_100000045678 [0,0,1,0,0,0|2,0,1]=4 603 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000093521_200000210301 [0,0,1,0,0,0|2,0,1]=4 604 B11R1.86 CC(=O)Cc1cccnc1F 1458a_100000070787_100000099810 [0,0,1,0,0,0|2,0,1]=4 605 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [0,0,1,0,0,0|3,0,0]=4 606 B11R1.86 [13CH3]C(=O)Cc1cccnc1Cl 1458a_100000093521_200025704644 [0,0,1,0,0,0|2,0,1]=4 607 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [0,0,1,0,0,0|2,0,1]=4 608 B11R1.91 C=C(C)CNc1cccnn1 27a_100000765925_100016991348 [0,0,1,0,0,0|2,0,1]=4 609 B11R1.91 C=C(C)CNc1ccncn1 27a_100000765925_100000703185 [0,0,1,0,0,0|2,0,1]=4 610 B11R1.91 C=C(C)CNc1cnccn1 27a_100000765925_100000211759 [0,0,1,0,0,0|2,0,1]=4 611 B11R1.91 C=C(C)CNc1ncccn1 27a_100000765925_100000211032 [0,0,1,0,0,0|2,0,1]=4 612 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [0,0,1,0,0,0|2,0,1]=4 613 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [0,0,1,0,0,0|2,0,1]=4 614 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [0,0,1,0,0,0|2,0,1]=4 615 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [0,0,1,0,0,0|2,0,1]=4 616 B11R1.91 C=C(C)CSc1ccccn1 62a_100000748629_100011216584 [0,0,1,0,0,0|1,0,1]=3 617 B11R1.91 C=C(C)CSc1ccccn1 62a_100011216584_100000211660 [0,0,1,0,0,0|1,0,1]=3 618 B11R1.91 C=C(C)CSc1cccnn1 62a_100000748629_100016991348 [0,0,1,0,0,0|2,0,1]=4 619 B11R1.91 C=C(C)CSc1cccnn1 62a_100016991348_100000211660 [0,0,1,0,0,0|2,0,1]=4 620 B11R1.91 C=C(C)CSc1ccncn1 62a_100000703185_100000211660 [0,0,1,0,0,0|2,0,1]=4 621 B11R1.91 C=C(C)CSc1ccncn1 62a_100000748629_100000703185 [0,0,1,0,0,0|2,0,1]=4 622 B11R1.91 C=C(C)CSc1cnccn1 62a_100000211759_100000211660 [0,0,1,0,0,0|2,0,1]=4 623 B11R1.91 C=C(C)CSc1cnccn1 62a_100000748629_100000211759 [0,0,1,0,0,0|2,0,1]=4 624 B11R1.91 C=C(C)CSc1ncccn1 62a_100000211032_100000211660 [0,0,1,0,0,0|2,0,1]=4 625 B11R1.91 C=C(C)CSc1ncccn1 62a_100000748629_100000211032 [0,0,1,0,0,0|2,0,1]=4 626 B11R1.91 C=C(F)CSc1ccccn1 62a_100000042424_100011216584 [0,0,1,0,0,0|2,0,1]=4 627 B11R1.91 C=C(F)CSc1ccccn1 62a_100011216584_100000042424 [0,0,1,0,0,0|2,0,1]=4 628 B11R1.91 CC(=O)C#Cc1ccccn1 1458a_102125277312_200000210301 [0,0,1,0,0,0|1,0,2]=4 629 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,0,1,0,0,0|2,0,0]=3 630 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [0,0,1,0,0,0|1,0,0]=2 631 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [0,0,1,0,0,0|3,0,0]=4 632 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [0,0,1,0,0,0|3,0,0]=4 633 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [0,0,1,0,0,0|1,0,2]=4 634 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [0,0,1,0,0,0|1,0,2]=4 635 B11R1.91 CC(=O)COc1ccccn1 1458a_100102699861_200000210301 [0,0,1,0,0,0|2,0,1]=4 636 B11R1.91 CC(=O)CSc1ccccn1 1458a_100000156281_200000210301 [0,0,1,0,0,0|2,0,1]=4 637 B11R1.91 CC(=O)NCc1ccccn1 11a_100000210449_100015343762 [0,0,1,0,0,0|2,0,1]=4 638 B11R1.91 CC(=O)NCc1ccccn1 1626a_100000210449_100015343762 [0,0,1,0,0,0|2,0,1]=4 639 B11R1.91 CC(=O)NCc1ccccn1 240690a_100000210449_100015343762 [0,0,1,0,0,0|2,0,1]=4 640 B11R1.91 CC(=O)NCc1ccccn1 527a_100000210449_100103153847 [0,0,1,0,0,0|2,0,1]=4 641 B11R1.91 CC(=O)NNc1ccccn1 22a_100000183288_100000070787 [0,0,1,0,0,0|3,0,0]=4 642 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [0,0,1,0,0,0|1,0,2]=4 643 B11R1.91 CC(C)C=Cc1ccccn1 271570a_100016257149_100011216584 [0,0,1,0,0,0|0,0,2]=3 644 B11R1.91 CC(C)C=Cc1cccnn1 271570a_100016257149_100016991348 [0,0,1,0,0,0|1,0,2]=4 645 B11R1.91 CC(C)C=Cc1ccncn1 271570a_100016257149_100000703185 [0,0,1,0,0,0|1,0,2]=4 646 B11R1.91 CC(C)C=Cc1cnccn1 271570a_100016257149_100000758340 [0,0,1,0,0,0|1,0,2]=4 647 B11R1.91 CC(C)C=Cc1ncccn1 271570a_100016257149_100000211032 [0,0,1,0,0,0|1,0,2]=4 648 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [0,0,1,0,0,0|2,0,1]=4 649 B11R1.91 CC(O)C=Cc1ccccn1 271570a_200011019289_100011216584 [0,0,1,0,0,0|1,0,1]=3 650 B11R1.91 CC(O)C=Cc1cccnn1 271570a_200011019289_100016991348 [0,0,1,0,0,0|2,0,1]=4 651 B11R1.91 CC(O)C=Cc1ccncn1 271570a_200011019289_100000703185 [0,0,1,0,0,0|2,0,1]=4 652 B11R1.91 CC(O)C=Cc1cnccn1 271570a_200011019289_100000758340 [0,0,1,0,0,0|2,0,1]=4 653 B11R1.91 CC(O)C=Cc1ncccn1 271570a_200011019289_100000211032 [0,0,1,0,0,0|2,0,1]=4 654 B11R1.91 [13CH3]C(=O)C#Cc1ccccn1 1458a_102125277312_200025704644 [0,0,1,0,0,0|1,0,2]=4 655 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,0,1,0,0,0|2,0,0]=3 656 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [0,0,1,0,0,0|1,0,0]=2 657 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [0,0,1,0,0,0|3,0,0]=4 658 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [0,0,1,0,0,0|3,0,0]=4 659 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [0,0,1,0,0,0|1,0,2]=4 660 B11R1.91 [13CH3]C(=O)COc1ccccn1 1458a_100102699861_200025704644 [0,0,1,0,0,0|2,0,1]=4 661 B11R1.91 [13CH3]C(=O)CSc1ccccn1 1458a_100000156281_200025704644 [0,0,1,0,0,0|2,0,1]=4 662 B11R1.182 C=C=Cc1cc(ccc1Br)Br 271570a_100015277604_100011483371 [0,0,1,0,0,0|2,0,1]=4 663 B11R1.182 C=C=Cc1cc(ccc1Br)C 271570a_100015277604_100012353751 [0,0,1,0,0,0|1,0,1]=3 664 B11R1.182 C=C=Cc1cc(ccc1Br)Cl 271570a_100015277604_100012339723 [0,0,1,0,0,0|2,0,1]=4 665 B11R1.182 C=C=Cc1cc(ccc1Br)F 271570a_100015277604_100011217576 [0,0,1,0,0,0|2,0,1]=4 666 B11R1.182 C=C=Cc1cc(ccc1Br)N 271570a_100015277604_100000750459 [0,0,1,0,0,0|2,0,1]=4 667 B11R1.182 C=C=Cc1cc(ccc1Br)O 271570a_100015277604_100012339312 [0,0,1,0,0,0|2,0,1]=4 668 B11R1.182 C=C=Cc1cc(ccc1C)Br 271570a_100015277604_100011344865 [0,0,1,0,0,0|2,0,1]=4 669 B11R1.182 C=C=Cc1cc(ccc1C)C 271570a_100015277604_100000210833 [0,0,1,0,0,0|1,0,1]=3 670 B11R1.182 C=C=Cc1cc(ccc1C)Cl 271570a_100015277604_100011263213 [0,0,1,0,0,0|2,0,1]=4 671 B11R1.182 C=C=Cc1cc(ccc1C)F 271570a_100015277604_100011218078 [0,0,1,0,0,0|2,0,1]=4 672 B11R1.182 C=C=Cc1cc(ccc1C)N 271570a_100015277604_100000736455 [0,0,1,0,0,0|2,0,1]=4 673 B11R1.182 C=C=Cc1cc(ccc1C)O 271570a_100015277604_100011380479 [0,0,1,0,0,0|2,0,1]=4 674 B11R1.182 C=C=Cc1cc(ccc1Cl)Br 271570a_100015277604_100011772130 [0,0,1,0,0,0|2,0,1]=4 675 B11R1.182 C=C=Cc1cc(ccc1Cl)C 271570a_100015277604_100012356289 [0,0,1,0,0,0|1,0,1]=3 676 B11R1.182 C=C=Cc1cc(ccc1Cl)Cl 271570a_100015277604_100000707729 [0,0,1,0,0,0|2,0,1]=4 677 B11R1.182 C=C=Cc1cc(ccc1Cl)F 271570a_100015277604_100011217299 [0,0,1,0,0,0|2,0,1]=4 678 B11R1.182 C=C=Cc1cc(ccc1Cl)N 271570a_100015277604_100012360549 [0,0,1,0,0,0|2,0,1]=4 679 B11R1.182 C=C=Cc1cc(ccc1Cl)O 271570a_100015277604_100000049588 [0,0,1,0,0,0|2,0,1]=4 680 B11R1.182 C=C=Cc1cc(ccc1F)Br 271570a_100015277604_100011217312 [0,0,1,0,0,0|2,0,1]=4 681 B11R1.182 C=C=Cc1cc(ccc1F)C 271570a_100015277604_100000736223 [0,0,1,0,0,0|1,0,1]=3 682 B11R1.182 C=C=Cc1cc(ccc1F)Cl 271570a_100015277604_100011218116 [0,0,1,0,0,0|2,0,1]=4 683 B11R1.182 C=C=Cc1cc(ccc1F)F 271570a_100015277604_100000750033 [0,0,1,0,0,0|2,0,1]=4 684 B11R1.182 C=C=Cc1cc(ccc1F)N 271570a_100015277604_100000760356 [0,0,1,0,0,0|2,0,1]=4 685 B11R1.182 C=C=Cc1cc(ccc1F)O 271570a_100015277604_100000693481 [0,0,1,0,0,0|2,0,1]=4 686 B11R1.182 C=C=Cc1cc(ccc1N)Br 271570a_100015277604_100000187925 [0,0,1,0,0,0|1,0,2]=4 687 B11R1.182 C=C=Cc1cc(ccc1N)C 271570a_100015277604_100000210942 [0,0,1,0,0,0|0,0,2]=3 688 B11R1.182 C=C=Cc1cc(ccc1N)Cl 271570a_100015277604_100000761889 [0,0,1,0,0,0|1,0,2]=4 689 B11R1.182 C=C=Cc1cc(ccc1N)F 271570a_100015277604_100000760547 [0,0,1,0,0,0|1,0,2]=4 690 B11R1.182 C=C=Cc1cc(ccc1N)N 271570a_100015277604_100011534242 [0,0,1,0,0,0|1,0,2]=4 691 B11R1.182 C=C=Cc1cc(ccc1N)O 271570a_100015277604_100012001276 [0,0,1,0,0,0|1,0,2]=4 692 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [0,0,1,0,0,0|2,0,1]=4 693 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [0,0,1,0,0,0|1,0,1]=3 694 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [0,0,1,0,0,0|2,0,1]=4 695 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [0,0,1,0,0,0|2,0,1]=4 696 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [0,0,1,0,0,0|2,0,1]=4 697 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [0,0,1,0,0,0|2,0,1]=4 698 B11R1.182 C=C=Cc1cc(cnc1C)C 271570a_100015277604_100009817436 [0,0,1,0,0,0|2,0,1]=4 699 B11R1.182 C=C=Cc1cc(cnc1Cl)C 271570a_100015277604_100010210167 [0,0,1,0,0,0|2,0,1]=4 700 B11R1.182 C=C=Cc1cc(cnc1F)C 271570a_100015277604_100000049784 [0,0,1,0,0,0|2,0,1]=4 701 B11R1.182 C=C=Cc1cc(cnc1N)C 271570a_100015277604_100000049664 [0,0,1,0,0,0|1,0,2]=4 702 B11R1.182 C=C=Cc1cc(cnc1O)C 271570a_100015277604_100000049931 [0,0,1,0,0,0|2,0,1]=4 703 B11R1.182 C=C=Cc1cc(ncc1C)C 271570a_100015277604_100009862788 [0,0,1,0,0,0|2,0,1]=4 704 B11R1.182 C=C=Cc1cc(ncc1F)C 271570a_100015277604_100009867690 [0,0,1,0,0,0|2,0,1]=4 705 B11R1.182 C=C=Cc1cc(ncc1O)C 271570a_100015277604_100009843476 [0,0,1,0,0,0|2,0,1]=4 706 B11R1.182 C=C=Cc1cn(ccc1=O)C 271570a_100015277604_100010750718 [0,0,1,0,0,0|2,0,1]=4 707 B11R1.182 C=C=Cc1nc(ccc1C)C 271570a_100015277604_100009854376 [0,0,1,0,0,0|2,0,1]=4 708 B11R1.182 C=C=Cc1nc(ccc1F)C 271570a_100015277604_100009817602 [0,0,1,0,0,0|2,0,1]=4 709 B11R1.182 C=C=Cc1nc(ccc1N)C 271570a_100015277604_100000685570 [0,0,1,0,0,0|1,0,2]=4 710 B11R1.182 C=C=Cc1nc(ccc1O)C 271570a_100015277604_100000702858 [0,0,1,0,0,0|2,0,1]=4 711 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [0,0,1,0,0,0|2,0,1]=4 712 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [0,0,1,0,0,0|1,0,1]=3 713 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [0,0,1,0,0,0|2,0,1]=4 714 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [0,0,1,0,0,0|2,0,1]=4 715 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [0,0,1,0,0,0|2,0,1]=4 716 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [0,0,1,0,0,0|2,0,1]=4 717 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [0,0,1,0,0,0|2,0,1]=4 718 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [0,0,1,0,0,0|1,0,1]=3 719 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [0,0,1,0,0,0|2,0,1]=4 720 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [0,0,1,0,0,0|2,0,1]=4 721 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [0,0,1,0,0,0|2,0,1]=4 722 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [0,0,1,0,0,0|2,0,1]=4 723 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [0,0,1,0,0,0|2,0,1]=4 724 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [0,0,1,0,0,0|1,0,1]=3 725 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [0,0,1,0,0,0|2,0,1]=4 726 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [0,0,1,0,0,0|2,0,1]=4 727 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [0,0,1,0,0,0|2,0,1]=4 728 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [0,0,1,0,0,0|2,0,1]=4 729 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [0,0,1,0,0,0|2,0,1]=4 730 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [0,0,1,0,0,0|1,0,1]=3 731 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [0,0,1,0,0,0|2,0,1]=4 732 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [0,0,1,0,0,0|2,0,1]=4 733 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [0,0,1,0,0,0|2,0,1]=4 734 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [0,0,1,0,0,0|2,0,1]=4 735 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [0,0,1,0,0,0|1,0,2]=4 736 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [0,0,1,0,0,0|0,0,2]=3 737 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [0,0,1,0,0,0|1,0,2]=4 738 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [0,0,1,0,0,0|1,0,2]=4 739 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [0,0,1,0,0,0|1,0,2]=4 740 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [0,0,1,0,0,0|1,0,2]=4 741 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [0,0,1,0,0,0|2,0,1]=4 742 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [0,0,1,0,0,0|1,0,1]=3 743 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [0,0,1,0,0,0|2,0,1]=4 744 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [0,0,1,0,0,0|2,0,1]=4 745 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [0,0,1,0,0,0|2,0,1]=4 746 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [0,0,1,0,0,0|2,0,1]=4 747 B11R1.182 CC=Cc1cc(cnc1C)C 271570a_100016259895_100009817436 [0,0,1,0,0,0|2,0,1]=4 748 B11R1.182 CC=Cc1cc(cnc1Cl)C 271570a_100016259895_100010210167 [0,0,1,0,0,0|2,0,1]=4 749 B11R1.182 CC=Cc1cc(cnc1F)C 271570a_100016259895_100000049784 [0,0,1,0,0,0|2,0,1]=4 750 B11R1.182 CC=Cc1cc(cnc1N)C 271570a_100016259895_100000049664 [0,0,1,0,0,0|1,0,2]=4 751 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [0,0,1,0,0,0|2,0,1]=4 752 B11R1.182 CC=Cc1cc(ncc1C)C 271570a_100016259895_100009862788 [0,0,1,0,0,0|2,0,1]=4 753 B11R1.182 CC=Cc1cc(ncc1F)C 271570a_100016259895_100009867690 [0,0,1,0,0,0|2,0,1]=4 754 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [0,0,1,0,0,0|2,0,1]=4 755 B11R1.182 CC=Cc1cn(ccc1=O)C 271570a_100016259895_100010750718 [0,0,1,0,0,0|2,0,1]=4 756 B11R1.182 CC=Cc1nc(ccc1C)C 271570a_100016259895_100009854376 [0,0,1,0,0,0|2,0,1]=4 757 B11R1.182 CC=Cc1nc(ccc1F)C 271570a_100016259895_100009817602 [0,0,1,0,0,0|2,0,1]=4 758 B11R1.182 CC=Cc1nc(ccc1N)C 271570a_100016259895_100000685570 [0,0,1,0,0,0|1,0,2]=4 759 B11R1.182 CC=Cc1nc(ccc1O)C 271570a_100016259895_100000702858 [0,0,1,0,0,0|2,0,1]=4 760 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,1,0|2,0,0]=3 761 B11R2.1 Oc1c[nH]c2c1cncn2 271570a_203496583355_100009817560 [0,0,0,0,1,0|3,0,0]=4 762 B11R2.1 Oc1cnc2n1cccn2 271570a_203496583355_100011934454 [0,0,0,0,1,0|3,0,0]=4 763 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,0,1,0|3,0,0]=4 764 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,0,1,0|3,0,0]=4 765 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,1,0|2,0,0]=3 766 B11R2.1 Oc1csc2c1nccn2 271570a_203496583355_100010174841 [0,0,0,0,1,0|3,0,0]=4 767 B11R2.1 Oc1n[nH]c2c1cccn2 271570a_203496583355_100009888962 [0,0,0,0,1,0|3,0,0]=4 768 B11R2.10 CN1Cc2cccnc2C1 269982a_100000726175_200000210301 [0,0,0,0,1,0|1,0,2]=4 769 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,0,1,0|3,0,0]=4 770 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,0,1,0|3,0,0]=4 771 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,0,1,0|3,0,0]=4 772 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [0,0,0,0,1,0|2,0,0]=3 773 B11R2.10 Oc1cn2ncccc2n1 271570a_203496583355_200010296001 [0,0,0,0,1,0|3,0,0]=4 774 B11R2.10 Oc1nc2cccnc2s1 271570a_203496583355_100010188088 [0,0,0,0,1,0|3,0,0]=4 775 B11R2.10 [13CH3]N1Cc2cccnc2C1 269982a_100000726175_200025704644 [0,0,0,0,1,0|1,0,2]=4 776 B11R2.36 Oc1cc2[nH]ccc2cn1 271570a_203496583355_100000089685 [0,0,0,0,1,0|3,0,0]=4 777 B11R2.36 Oc1cc2cc[nH]c2cn1 271570a_203496583355_100009864809 [0,0,0,0,1,0|2,0,1]=4 778 B11R2.36 Oc1cc2sccc2cn1 271570a_203496583355_200016184645 [0,0,0,0,1,0|3,0,0]=4 779 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [0,0,0,0,1,0|1,0,1]=3 780 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [0,0,0,0,1,0|2,0,1]=4 781 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [0,0,0,0,1,0|2,0,1]=4 782 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [0,0,0,0,1,0|2,0,1]=4 783 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [0,0,0,0,1,0|1,0,1]=3 784 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [0,0,0,0,1,0|1,0,1]=3 785 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [0,0,0,0,1,0|2,0,0]=3 786 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [0,0,0,0,1,0|3,0,0]=4 787 B11R2.36 Oc1ccc2ccnn2c1 271570a_203496583355_100009820231 [0,0,0,0,1,0|3,0,0]=4 788 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [0,0,0,0,1,0|2,0,0]=3 789 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [0,0,0,0,1,0|2,0,0]=3 790 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [0,0,0,0,1,0|3,0,0]=4 791 B11R2.36 Oc1ccc2cncn2c1 271570a_203496583355_100009887162 [0,0,0,0,1,0|3,0,0]=4 792 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [0,0,0,0,1,0|3,0,0]=4 793 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [0,0,0,0,1,0|2,0,0]=3 794 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [0,0,0,0,1,0|3,0,0]=4 795 B11R2.36 Oc1ccc2nc[nH]c2n1 271570a_203496583355_100000077665 [0,0,0,0,1,0|3,0,0]=4 796 B11R2.36 Oc1ccc2nccn2c1 271570a_203496583355_100000746083 [0,0,0,0,1,0|2,0,0]=3 797 B11R2.36 Oc1ccc2nccn2n1 271570a_203496583355_100009883166 [0,0,0,0,1,0|3,0,0]=4 798 B11R2.36 Oc1ccc2ncnn2c1 271570a_203496583355_100009816971 [0,0,0,0,1,0|3,0,0]=4 799 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [0,0,0,0,1,0|2,0,0]=3 800 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [0,0,0,0,1,0|2,0,0]=3 801 B11R2.36 Oc1ccc2ncsc2n1 271570a_203496583355_100010381354 [0,0,0,0,1,0|3,0,0]=4 802 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [0,0,0,0,1,0|3,0,0]=4 803 B11R2.36 Oc1ccc2nncn2c1 271570a_203496583355_100000764363 [0,0,0,0,1,0|3,0,0]=4 804 B11R2.36 Oc1ccc2nonc2c1 271570a_203496583355_100009814275 [0,0,0,0,1,0|3,0,0]=4 805 B11R2.36 Oc1ccc2nsnc2c1 271570a_203496583355_100009814274 [0,0,0,0,1,0|3,0,0]=4 806 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [0,0,0,0,1,0|2,0,0]=3 807 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [0,0,0,0,1,0|3,0,0]=4 808 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [0,0,0,0,1,0|3,0,0]=4 809 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [0,0,0,0,1,0|3,0,0]=4 810 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [0,0,0,0,1,0|2,0,0]=3 811 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [0,0,0,0,1,0|3,0,0]=4 812 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [0,0,0,0,1,0|3,0,0]=4 813 B11R2.36 Oc1ccn2ccnc2c1 271570a_203496583355_100009816855 [0,0,0,0,1,0|3,0,0]=4 814 B11R2.36 Oc1ccn2nccc2c1 271570a_203496583355_100000763084 [0,0,0,0,1,0|2,0,0]=3 815 B11R2.36 Oc1ccn2nccc2n1 271570a_203496583355_100000691470 [0,0,0,0,1,0|3,0,0]=4 816 B11R2.36 Oc1ccn2ncnc2c1 271570a_203496583355_100009819723 [0,0,0,0,1,0|3,0,0]=4 817 B11R2.36 Oc1ccn2nncc2c1 271570a_203496583355_100009820036 [0,0,0,0,1,0|3,0,0]=4 818 B11R2.36 Oc1cn2ccnc2cn1 271570a_203496583355_102495339940 [0,0,0,0,1,0|3,0,0]=4 819 B11R2.36 Oc1cnc2[nH]ccc2c1 271570a_203496583355_100000760471 [0,0,0,0,1,0|2,0,1]=4 820 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [0,0,0,0,1,0|3,0,0]=4 821 B11R2.36 Oc1cnc2nc[nH]c2c1 271570a_203496583355_100000760087 [0,0,0,0,1,0|3,0,0]=4 822 B11R2.36 Oc1cnc2nccn2c1 271570a_203496583355_100000764708 [0,0,0,0,1,0|3,0,0]=4 823 B11R2.36 Oc1cnc2ncoc2c1 271570a_203496583355_100000721906 [0,0,0,0,1,0|3,0,0]=4 824 B11R2.36 Oc1cnc2nscc2c1 271570a_203496583355_200020642285 [0,0,0,0,1,0|3,0,0]=4 825 B11R2.36 Oc1cnc2sccc2c1 271570a_203496583355_100010135160 [0,0,0,0,1,0|3,0,0]=4 826 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,0,1,0,0,0|1,0,1]=4 827 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,0,1,0,0,0|1,0,1]=4 828 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,0,1,0,0,0|0,0,1]=3 829 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,0,1,0,0,0|1,0,1]=4 830 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,0,1,0,0,0|1,0,1]=4 831 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,0,1,0,0,0|1,0,1]=4 832 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,0,1,0,0,0|1,0,1]=4 833 B10R1.1 C=C=Cc1ccc(cn1)C 271570a_100015277604_100000754016 [1,0,1,0,0,0|1,0,1]=4 834 B10R1.1 C=C=Cc1ccc(nc1)C 271570a_100015277604_100000751577 [1,0,1,0,0,0|1,0,1]=4 835 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,0,1,0,0,0|1,0,1]=4 836 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,0,1,0,0,0|0,0,1]=3 837 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,0,1,0,0,0|1,0,1]=4 838 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,0,1,0,0,0|1,0,1]=4 839 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,0,1,0,0,0|1,0,1]=4 840 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,0,1,0,0,0|1,0,1]=4 841 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,0,1,0,0,0|1,0,1]=4 842 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,0,1,0,0,0|1,0,1]=4 843 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,0,1,0,0,0|2,0,0]=4 844 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,0,1,0,0,0|0,0,2]=4 845 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 846 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 847 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [1,0,1,0,0,0|1,0,1]=4 848 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [1,0,1,0,0,0|1,0,1]=4 849 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,0,1,0,0,0|1,0,1]=4 850 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,0,1,0,0,0|1,0,1]=4 851 B10R1.17 C=CCSc1ccccn1 62a_100000210623_100011216584 [1,0,1,0,0,0|1,0,1]=4 852 B10R1.17 C=CCSc1ccccn1 62a_100011216584_100000210623 [1,0,1,0,0,0|1,0,1]=4 853 B10R1.17 C=CCSc1cccnc1 62a_100000210063_100000210623 [1,0,1,0,0,0|1,0,1]=4 854 B10R1.17 C=CCSc1cccnc1 62a_100000210623_100000210063 [1,0,1,0,0,0|1,0,1]=4 855 B10R1.17 CC=NNc1ccccn1 4a_100000183288_200000210099 [1,0,1,0,0,0|2,0,0]=4 856 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,0,1,0,0,0|1,0,1]=4 857 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,0,1,0,0,0|1,0,1]=4 858 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,0,1,0,0,0|1,0,1]=4 859 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,0,1,0,0,0|1,0,1]=4 860 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,0,1,0,0,0|0,0,2]=4 861 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,0,1,0,0,0|1,0,1]=4 862 B10R1.4 C=C=Cc1cccnc1Br 271570a_100015277604_100010202626 [1,0,1,0,0,0|1,0,1]=4 863 B10R1.4 C=C=Cc1cccnc1C 271570a_100015277604_100000751574 [1,0,1,0,0,0|0,0,2]=4 864 B10R1.4 C=C=Cc1cccnc1Cl 271570a_100015277604_100000036424 [1,0,1,0,0,0|1,0,1]=4 865 B10R1.4 C=C=Cc1cccnc1F 271570a_100015277604_100009816115 [1,0,1,0,0,0|1,0,1]=4 866 B10R1.4 C=C=Cc1cccnc1N 271570a_100015277604_100000045569 [1,0,1,0,0,0|1,0,1]=4 867 B10R1.4 C=C=Cc1ncccc1Br 271570a_100015277604_100000696092 [1,0,1,0,0,0|1,0,1]=4 868 B10R1.4 C=C=Cc1ncccc1C 271570a_100015277604_100000751373 [1,0,1,0,0,0|0,0,2]=4 869 B10R1.4 C=C=Cc1ncccc1Cl 271570a_100015277604_100011356963 [1,0,1,0,0,0|1,0,1]=4 870 B10R1.4 C=C=Cc1ncccc1F 271570a_100015277604_100000685392 [1,0,1,0,0,0|1,0,1]=4 871 B10R1.4 C=C=Cc1ncccc1N 271570a_100015277604_100000688686 [1,0,1,0,0,0|1,0,1]=4 872 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [1,0,1,0,0,0|1,0,1]=4 873 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,0,1,0,0,0|1,0,1]=4 874 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [1,0,1,0,0,0|1,0,1]=4 875 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,0,1,0,0,0|1,0,1]=4 876 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,0,1,0,0,0|1,0,1]=4 877 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,0,1,0,0,0|1,0,1]=4 878 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,0,1,0,0,0|1,0,1]=4 879 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,0,1,0,0,0|0,0,2]=4 880 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,0,1,0,0,0|1,0,1]=4 881 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [1,0,1,0,0,0|1,0,0]=3 882 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [1,0,1,0,0,0|0,0,1]=3 883 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [1,0,1,0,0,0|1,0,0]=3 884 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [1,0,1,0,0,0|1,0,0]=3 885 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [1,0,1,0,0,0|1,0,0]=3 886 B10R1.4 CC=Cc1cncnc1Br 271570a_100016259895_200012461658 [1,0,1,0,0,0|2,0,0]=4 887 B10R1.4 CC=Cc1cncnc1C 271570a_100016259895_100009819671 [1,0,1,0,0,0|1,0,1]=4 888 B10R1.4 CC=Cc1cncnc1Cl 271570a_100016259895_100000758962 [1,0,1,0,0,0|2,0,0]=4 889 B10R1.4 CC=Cc1cncnc1N 271570a_100016259895_100011996079 [1,0,1,0,0,0|2,0,0]=4 890 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [1,0,1,0,0,0|2,0,0]=4 891 B10R1.4 CC=Cc1ncc[nH]c1=O 271570a_100016259895_100000763361 [1,0,1,0,0,0|2,0,0]=4 892 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [1,0,1,0,0,0|1,0,0]=3 893 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [1,0,1,0,0,0|0,0,1]=3 894 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [1,0,1,0,0,0|1,0,0]=3 895 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [1,0,1,0,0,0|1,0,0]=3 896 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [1,0,1,0,0,0|1,0,0]=3 897 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,0,1,0,0,0|1,0,0]=3 898 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [1,0,1,0,0,0|1,0,1]=4 899 B10R1.4 CC=Cc1nccnc1F 271570a_100016259895_200010125657 [1,0,1,0,0,0|2,0,0]=4 900 B10R1.4 CC=Cc1nccnc1N 271570a_100016259895_100000747729 [1,0,1,0,0,0|2,0,0]=4 901 B10R1.4 CC=Cc1ncncc1C 271570a_100016259895_100011998708 [1,0,1,0,0,0|1,0,1]=4 902 B10R1.4 CC=Cc1ncncc1F 271570a_100016259895_100000069762 [1,0,1,0,0,0|2,0,0]=4 903 B10R1.4 CC=Cc1ncncc1N 271570a_100016259895_100000709731 [1,0,1,0,0,0|2,0,0]=4 904 B10R1.4 CC=Cc1nnccc1C 271570a_100016259895_100000089043 [1,0,1,0,0,0|1,0,1]=4 905 B10R1.10 C=C=Cc1cc(ccn1)C 271570a_100015277604_100000750283 [1,0,1,0,0,0|1,0,1]=4 906 B10R1.10 C=C=Cc1ccc[n+](c1)C 271570a_100015277604_100009996589 [1,0,1,0,0,0|1,0,1]=4 907 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,0,1,0,0,0|1,0,1]=4 908 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,0,1,0,0,0|0,0,1]=3 909 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,0,1,0,0,0|1,0,1]=4 910 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,0,1,0,0,0|1,0,1]=4 911 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,0,1,0,0,0|1,0,1]=4 912 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,0,1,0,0,0|1,0,1]=4 913 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,0,1,0,0,0|1,0,1]=4 914 B10R1.10 C=C=Cc1cccc(n1)C 271570a_100015277604_100000742759 [1,0,1,0,0,0|1,0,1]=4 915 B10R1.10 C=C=Cc1ccnc(c1)C 271570a_100015277604_100000758586 [1,0,1,0,0,0|1,0,1]=4 916 B10R1.10 C=C=Cc1cncc(c1)C 271570a_100015277604_100000760492 [1,0,1,0,0,0|1,0,1]=4 917 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,1,0,0,0|1,0,1]=4 918 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,0,1,0,0,0|1,0,1]=4 919 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,0,1,0,0,0|1,0,1]=4 920 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,0,1,0,0,0|1,0,1]=4 921 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,1,0,0,0|0,0,1]=3 922 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,0,1,0,0,0|1,0,1]=4 923 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,0,1,0,0,0|1,0,1]=4 924 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,0,1,0,0,0|1,0,1]=4 925 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,1,0,0,0|1,0,1]=4 926 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,0,1,0,0,0|1,0,1]=4 927 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,0,1,0,0,0|1,0,1]=4 928 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,0,1,0,0,0|1,0,1]=4 929 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,0,1,0,0,0|1,0,1]=4 930 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [1,0,1,0,0,0|2,0,0]=4 931 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [1,0,1,0,0,0|2,0,0]=4 932 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,0,1,0,0,0|1,0,1]=4 933 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,0,1,0,0,0|2,0,0]=4 934 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,0,1,0,0,0|2,0,0]=4 935 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,0,1,0,0,0|0,0,2]=4 936 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,0,1,0,0,0|0,0,2]=4 937 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [1,0,1,0,0,0|1,0,1]=4 938 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,0,1,0,0,0|0,0,2]=4 939 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,0,1,0,0,0|1,0,1]=4 940 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,0,1,0,0,0|1,0,1]=4 941 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,0,1,0,0,0|1,0,1]=4 942 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,0,1,0,0,0|1,0,1]=4 943 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,0,1,0,0,0|1,0,1]=4 944 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,0,1,0,0,0|1,0,1]=4 945 B10R1.20 C=Cc1cccnc1C#N 271570a_100011290941_100000685805 [1,0,1,0,0,0|1,0,1]=4 946 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,0,1,0,0,0|1,0,0]=3 947 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [1,0,1,0,0,0|0,0,2]=4 948 B10R1.20 C=Cc1cccnc1CN 271570a_100011290941_100020591323 [1,0,1,0,0,0|1,0,1]=4 949 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [1,0,1,0,0,0|1,0,1]=4 950 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [1,0,1,0,0,0|1,0,1]=4 951 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [1,0,1,0,0,0|2,0,0]=4 952 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [1,0,1,0,0,0|1,0,1]=4 953 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [1,0,1,0,0,0|1,0,1]=4 954 B10R1.20 C=Cc1ncccc1C#N 271570a_100011290941_100000211984 [1,0,1,0,0,0|1,0,1]=4 955 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,0,1,0,0,0|1,0,0]=3 956 B10R1.20 C=Cc1ncccc1CN 271570a_100011290941_100015189234 [1,0,1,0,0,0|1,0,1]=4 957 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [1,0,1,0,0,0|1,0,1]=4 958 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [1,0,1,0,0,0|1,0,0]=3 959 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [1,0,1,0,0,0|1,0,0]=3 960 B10R1.20 C=Cc1nccnc1CC 271570a_100011290941_100011995844 [1,0,1,0,0,0|1,0,1]=4 961 B10R1.20 C=Cc1nccnc1NC 271570a_100011290941_100011529439 [1,0,1,0,0,0|2,0,0]=4 962 B10R1.20 C=Cc1nccnc1OC 271570a_100011290941_100000749998 [1,0,1,0,0,0|2,0,0]=4 963 B10R1.20 C=Cc1ncncc1CC 271570a_100011290941_200000100055 [1,0,1,0,0,0|1,0,1]=4 964 B10R1.20 C=Cc1ncncc1OC 271570a_100011290941_100012001275 [1,0,1,0,0,0|2,0,0]=4 965 B10R1.20 CSc1cccnc1C=O 62a_100011934733_200000210301 [1,0,1,0,0,0|2,0,0]=4 966 B10R1.20 CSc1cccnc1C=O 62a_200000210301_100011934733 [1,0,1,0,0,0|2,0,0]=4 967 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_100011934733_200025704644 [1,0,1,0,0,0|2,0,0]=4 968 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_200025704644_100011934733 [1,0,1,0,0,0|2,0,0]=4 969 B10R1.25 C=Cc1ccc(c[n+]1[O-])C 271570a_100011290941_100009819918 [1,0,1,0,0,0|2,0,0]=4 970 B10R1.25 C=Cc1ccc(cc1Br)Br 271570a_100011290941_100011484698 [1,0,1,0,0,0|2,0,0]=4 971 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [1,0,1,0,0,0|1,0,0]=3 972 B10R1.25 C=Cc1ccc(cc1Br)Cl 271570a_100011290941_100011219703 [1,0,1,0,0,0|2,0,0]=4 973 B10R1.25 C=Cc1ccc(cc1Br)F 271570a_100011290941_100011217111 [1,0,1,0,0,0|2,0,0]=4 974 B10R1.25 C=Cc1ccc(cc1Br)N 271570a_100011290941_100000750458 [1,0,1,0,0,0|2,0,0]=4 975 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,0,1,0,0,0|2,0,0]=4 976 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [1,0,1,0,0,0|1,0,1]=4 977 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [1,0,1,0,0,0|0,0,1]=3 978 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [1,0,1,0,0,0|1,0,1]=4 979 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [1,0,1,0,0,0|1,0,1]=4 980 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [1,0,1,0,0,0|1,0,1]=4 981 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,0,1,0,0,0|1,0,1]=4 982 B10R1.25 C=Cc1ccc(cc1Cl)Br 271570a_100011290941_100011216062 [1,0,1,0,0,0|2,0,0]=4 983 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [1,0,1,0,0,0|1,0,0]=3 984 B10R1.25 C=Cc1ccc(cc1Cl)Cl 271570a_100011290941_100000699841 [1,0,1,0,0,0|2,0,0]=4 985 B10R1.25 C=Cc1ccc(cc1Cl)F 271570a_100011290941_100000733362 [1,0,1,0,0,0|2,0,0]=4 986 B10R1.25 C=Cc1ccc(cc1Cl)N 271570a_100011290941_100000761885 [1,0,1,0,0,0|2,0,0]=4 987 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,0,1,0,0,0|2,0,0]=4 988 B10R1.25 C=Cc1ccc(cc1F)Br 271570a_100011290941_100009814013 [1,0,1,0,0,0|2,0,0]=4 989 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [1,0,1,0,0,0|1,0,0]=3 990 B10R1.25 C=Cc1ccc(cc1F)Cl 271570a_100011290941_100011216042 [1,0,1,0,0,0|2,0,0]=4 991 B10R1.25 C=Cc1ccc(cc1F)F 271570a_100011290941_100000750030 [1,0,1,0,0,0|2,0,0]=4 992 B10R1.25 C=Cc1ccc(cc1F)N 271570a_100011290941_100011356925 [1,0,1,0,0,0|2,0,0]=4 993 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,0,1,0,0,0|2,0,0]=4 994 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [1,0,1,0,0,0|2,0,0]=4 995 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [1,0,1,0,0,0|1,0,0]=3 996 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [1,0,1,0,0,0|2,0,0]=4 997 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [1,0,1,0,0,0|2,0,0]=4 998 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [1,0,1,0,0,0|2,0,0]=4 999 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,0,1,0,0,0|2,0,0]=4 1000 B10R1.25 C=Cc1ccc(cc1O)Br 271570a_100011290941_100012344904 [1,0,1,0,0,0|2,0,0]=4 1001 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [1,0,1,0,0,0|1,0,0]=3 1002 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [1,0,1,0,0,0|2,0,0]=4 1003 B10R1.25 C=Cc1ccc(cc1O)F 271570a_100011290941_100000690578 [1,0,1,0,0,0|2,0,0]=4 1004 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,0,1,0,0,0|2,0,0]=4 1005 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [1,0,1,0,0,0|1,0,1]=4 1006 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [1,0,1,0,0,0|2,0,0]=4 1007 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [1,0,1,0,0,0|2,0,0]=4 1008 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [1,0,1,0,0,0|2,0,0]=4 1009 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [1,0,1,0,0,0|1,0,1]=4 1010 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [1,0,1,0,0,0|2,0,0]=4 1011 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [1,0,1,0,0,0|2,0,0]=4 1012 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [1,0,1,0,0,0|1,0,1]=4 1013 B10R1.25 C=Cc1ncc(cc1F)C 271570a_100011290941_100009819633 [1,0,1,0,0,0|2,0,0]=4 1014 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [1,0,1,0,0,0|2,0,0]=4 1015 B10R1.25 C=Cc1ncc(cc1O)C 271570a_100011290941_100012000487 [1,0,1,0,0,0|2,0,0]=4 1016 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [1,0,1,0,0,0|2,0,0]=4 1017 B10R1.30 C=Cc1cc(ccc1Br)Br 271570a_100011290941_100011483371 [1,0,1,0,0,0|2,0,0]=4 1018 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,0,1,0,0,0|1,0,0]=3 1019 B10R1.30 C=Cc1cc(ccc1Br)Cl 271570a_100011290941_100012339723 [1,0,1,0,0,0|2,0,0]=4 1020 B10R1.30 C=Cc1cc(ccc1Br)F 271570a_100011290941_100011217576 [1,0,1,0,0,0|2,0,0]=4 1021 B10R1.30 C=Cc1cc(ccc1Br)N 271570a_100011290941_100000750459 [1,0,1,0,0,0|2,0,0]=4 1022 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,0,1,0,0,0|2,0,0]=4 1023 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [1,0,1,0,0,0|1,0,1]=4 1024 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,0,1,0,0,0|0,0,1]=3 1025 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [1,0,1,0,0,0|1,0,1]=4 1026 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [1,0,1,0,0,0|1,0,1]=4 1027 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [1,0,1,0,0,0|1,0,1]=4 1028 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,0,1,0,0,0|1,0,1]=4 1029 B10R1.30 C=Cc1cc(ccc1Cl)Br 271570a_100011290941_100011772130 [1,0,1,0,0,0|2,0,0]=4 1030 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,0,1,0,0,0|1,0,0]=3 1031 B10R1.30 C=Cc1cc(ccc1Cl)Cl 271570a_100011290941_100000707729 [1,0,1,0,0,0|2,0,0]=4 1032 B10R1.30 C=Cc1cc(ccc1Cl)F 271570a_100011290941_100011217299 [1,0,1,0,0,0|2,0,0]=4 1033 B10R1.30 C=Cc1cc(ccc1Cl)N 271570a_100011290941_100012360549 [1,0,1,0,0,0|2,0,0]=4 1034 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,0,1,0,0,0|2,0,0]=4 1035 B10R1.30 C=Cc1cc(ccc1F)Br 271570a_100011290941_100011217312 [1,0,1,0,0,0|2,0,0]=4 1036 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,0,1,0,0,0|1,0,0]=3 1037 B10R1.30 C=Cc1cc(ccc1F)Cl 271570a_100011290941_100011218116 [1,0,1,0,0,0|2,0,0]=4 1038 B10R1.30 C=Cc1cc(ccc1F)F 271570a_100011290941_100000750033 [1,0,1,0,0,0|2,0,0]=4 1039 B10R1.30 C=Cc1cc(ccc1F)N 271570a_100011290941_100000760356 [1,0,1,0,0,0|2,0,0]=4 1040 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,0,1,0,0,0|2,0,0]=4 1041 B10R1.30 C=Cc1cc(ccc1N)Br 271570a_100011290941_100000187925 [1,0,1,0,0,0|1,0,1]=4 1042 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,0,1,0,0,0|0,0,1]=3 1043 B10R1.30 C=Cc1cc(ccc1N)Cl 271570a_100011290941_100000761889 [1,0,1,0,0,0|1,0,1]=4 1044 B10R1.30 C=Cc1cc(ccc1N)F 271570a_100011290941_100000760547 [1,0,1,0,0,0|1,0,1]=4 1045 B10R1.30 C=Cc1cc(ccc1N)N 271570a_100011290941_100011534242 [1,0,1,0,0,0|1,0,1]=4 1046 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,0,1,0,0,0|1,0,1]=4 1047 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,0,1,0,0,0|2,0,0]=4 1048 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,0,1,0,0,0|1,0,0]=3 1049 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,0,1,0,0,0|2,0,0]=4 1050 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,0,1,0,0,0|2,0,0]=4 1051 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,0,1,0,0,0|2,0,0]=4 1052 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,0,1,0,0,0|2,0,0]=4 1053 B10R1.30 C=Cc1cc(cnc1C)C 271570a_100011290941_100009817436 [1,0,1,0,0,0|1,0,1]=4 1054 B10R1.30 C=Cc1cc(cnc1Cl)C 271570a_100011290941_100010210167 [1,0,1,0,0,0|2,0,0]=4 1055 B10R1.30 C=Cc1cc(cnc1F)C 271570a_100011290941_100000049784 [1,0,1,0,0,0|2,0,0]=4 1056 B10R1.30 C=Cc1cc(cnc1N)C 271570a_100011290941_100000049664 [1,0,1,0,0,0|1,0,1]=4 1057 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [1,0,1,0,0,0|2,0,0]=4 1058 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [1,0,1,0,0,0|1,0,1]=4 1059 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [1,0,1,0,0,0|2,0,0]=4 1060 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [1,0,1,0,0,0|2,0,0]=4 1061 B10R1.30 C=Cc1cn(ccc1=O)C 271570a_100011290941_100010750718 [1,0,1,0,0,0|2,0,0]=4 1062 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [1,0,1,0,0,0|1,0,1]=4 1063 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [1,0,1,0,0,0|2,0,0]=4 1064 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [1,0,1,0,0,0|1,0,1]=4 1065 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [1,0,1,0,0,0|2,0,0]=4 1066 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,0,1,0,0,0|2,0,0]=4 1067 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,1,0,0,0|1,0,1]=4 1068 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,1,0,0,0|0,0,1]=3 1069 B10R1.18 CC(=Cc1cccnn1)C 271570a_100102525489_100016991348 [1,0,1,0,0,0|1,0,1]=4 1070 B10R1.18 CC(=Cc1ccnnc1)C 271570a_100102525489_100000732662 [1,0,1,0,0,0|1,0,1]=4 1071 B10R1.18 CC(=Cc1cnccn1)C 271570a_100102525489_100000758340 [1,0,1,0,0,0|1,0,1]=4 1072 B10R1.18 CC(=Cc1cncnc1)C 271570a_100102525489_100011206942 [1,0,1,0,0,0|1,0,1]=4 1073 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,0,1,0,0,0|1,0,1]=4 1074 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,0,1,0,0,0|1,0,1]=4 1075 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,0,1,0,0,0|1,0,1]=4 1076 B12R1.1 C/C=C/CNc1ccc(cc1)C 34a_100000124888_100102629194 [0,1,1,0,0,0|0,0,2]=4 1077 B12R1.1 C/C=C/COc1ccc(cc1)C 34a_100000210336_100102629194 [0,1,1,0,0,0|1,0,1]=4 1078 B12R1.1 C/C=C/COc1ccc(cc1)C 7a_100000210336_100102629194 [0,1,1,0,0,0|1,0,1]=4 1079 B12R1.1 C/C=C/CSc1ccc(cc1)C 62a_100000186775_100102629194 [0,1,1,0,0,0|1,0,1]=4 1080 B12R1.1 C/C=C/CSc1ccc(cc1)C 62a_100102629194_100000186775 [0,1,1,0,0,0|1,0,1]=4 1081 B12R1.1 C=CCCNc1ccc(cc1)C 34a_100000124888_100000754431 [0,1,1,0,0,0|0,0,2]=4 1082 B12R1.1 C=CCCOc1ccc(cc1)C 34a_100000210336_100000754431 [0,1,1,0,0,0|1,0,1]=4 1083 B12R1.1 C=CCCOc1ccc(cc1)C 7a_100000210336_100000754431 [0,1,1,0,0,0|1,0,1]=4 1084 B12R1.1 C=CCCSc1ccc(cc1)C 62a_100000186775_100000754431 [0,1,1,0,0,0|1,0,1]=4 1085 B12R1.1 C=CCCSc1ccc(cc1)C 62a_100000754431_100000186775 [0,1,1,0,0,0|1,0,1]=4 1086 B12R1.1 C=CCNCc1ccc(cc1)C 2230a_100000174908_100000210623 [0,1,1,0,0,0|0,0,2]=4 1087 B12R1.1 C=CCNCc1ccc(cc1)C 2230a_100020586998_100000210814 [0,1,1,0,0,0|0,0,2]=4 1088 B12R1.1 C=CCNCc1ccc(cc1)C 270004a_100020586998_100000211033 [0,1,1,0,0,0|0,0,2]=4 1089 B12R1.1 C=CCNCc1ccc(cc1)C 34a_100000174908_100015514636 [0,1,1,0,0,0|0,0,2]=4 1090 B12R1.1 C=CCOCc1ccc(cc1)C 34a_100011215236_100015514636 [0,1,1,0,0,0|1,0,1]=4 1091 B12R1.1 C=CCOCc1ccc(cc1)C 34a_200000210373_100000210814 [0,1,1,0,0,0|1,0,1]=4 1092 B12R1.1 C=CCOCc1ccc(cc1)C 7a_100011215236_100015514636 [0,1,1,0,0,0|1,0,1]=4 1093 B12R1.1 C=CCSCc1ccc(cc1)C 62a_100000210623_100000210814 [0,1,1,0,0,0|1,0,1]=4 1094 B12R1.1 C=CCSCc1ccc(cc1)C 62a_100000210814_100000210623 [0,1,1,0,0,0|1,0,1]=4 1095 B12R1.1 CC=CCNc1ccc(cc1)C 34a_100000124888_100000070051 [0,1,1,0,0,0|0,0,2]=4 1096 B12R1.1 CC=CCOc1ccc(cc1)C 34a_100000210336_100000070051 [0,1,1,0,0,0|1,0,1]=4 1097 B12R1.1 CC=CCOc1ccc(cc1)C 7a_100000210336_100000070051 [0,1,1,0,0,0|1,0,1]=4 1098 B12R1.1 CC=CCSc1ccc(cc1)C 62a_100000070051_100000186775 [0,1,1,0,0,0|1,0,1]=4 1099 B12R1.1 CC=CCSc1ccc(cc1)C 62a_100000186775_100000070051 [0,1,1,0,0,0|1,0,1]=4 1100 B12R1.1 CCC=NNc1ccc(cc1)C 4a_100000683527_100000210100 [0,1,1,0,0,0|0,0,2]=4 1101 B12R1.16 C=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210623 [0,1,1,0,0,0|1,0,1]=4 1102 B12R1.16 C=CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210623 [0,1,1,0,0,0|0,0,2]=4 1103 B12R1.16 C=CCN(C)c1ccc(cc1)C 269982a_100000219977_100000210623 [0,1,1,0,0,0|0,0,2]=4 1104 B12R1.16 C=CCN(C)c1ccc(cc1)C 34a_100000219977_100015514636 [0,1,1,0,0,0|0,0,2]=4 1105 B12R1.21 C=C(C)CNc1ccc(cc1)C 34a_100000124888_100000748629 [0,1,1,0,0,0|0,0,2]=4 1106 B12R1.21 C=C(C)COc1ccc(cc1)C 34a_100000210336_100000748629 [0,1,1,0,0,0|1,0,1]=4 1107 B12R1.21 C=C(C)COc1ccc(cc1)C 7a_100000210336_100000748629 [0,1,1,0,0,0|1,0,1]=4 1108 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000186775_100000211660 [0,1,1,0,0,0|1,0,1]=4 1109 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000748629_100000186775 [0,1,1,0,0,0|1,0,1]=4 1110 B12R1.21 C=C(F)CNc1ccc(cc1)C 34a_100000124888_100009893438 [0,1,1,0,0,0|0,0,2]=4 1111 B12R1.21 C=C(F)COc1ccc(cc1)C 34a_100000210336_100009893438 [0,1,1,0,0,0|1,0,1]=4 1112 B12R1.21 C=C(F)COc1ccc(cc1)C 7a_100000210336_100000042424 [0,1,1,0,0,0|1,0,1]=4 1113 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000042424_100000186775 [0,1,1,0,0,0|1,0,1]=4 1114 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000186775_100000042424 [0,1,1,0,0,0|1,0,1]=4 1115 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [0,1,1,0,0,0|1,0,1]=4 1116 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [0,1,1,0,0,0|1,0,1]=4 1117 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [0,1,1,0,0,0|2,0,0]=4 1118 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [0,1,1,0,0,0|1,0,0]=3 1119 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [0,1,1,0,0,0|2,0,0]=4 1120 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [0,1,1,0,0,0|2,0,0]=4 1121 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [0,1,1,0,0,0|2,0,0]=4 1122 B12R1.49 C=CC(=O)Cc1ccc(cn1)C 1458a_100000185746_100000691093 [0,1,1,0,0,0|2,0,0]=4 1123 B12R1.49 C=CC(=O)Cc1ccc(nc1)C 1458a_100000185746_100016987292 [0,1,1,0,0,0|2,0,0]=4 1124 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [0,1,1,0,0,0|1,0,1]=4 1125 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [0,1,1,0,0,0|1,0,1]=4 1126 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [0,1,1,0,0,0|0,0,1]=3 1127 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [0,1,1,0,0,0|0,0,1]=3 1128 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [0,1,1,0,0,0|1,0,1]=4 1129 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [0,1,1,0,0,0|1,0,1]=4 1130 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [0,1,1,0,0,0|1,0,1]=4 1131 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [0,1,1,0,0,0|1,0,1]=4 1132 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [0,1,1,0,0,0|1,0,1]=4 1133 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [0,1,1,0,0,0|1,0,1]=4 1134 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [0,1,1,0,0,0|1,0,1]=4 1135 B12R1.49 C=CC(C)Sc1ccc(cc1)C 62a_100011215867_100000186775 [0,1,1,0,0,0|1,0,1]=4 1136 B12R1.69 C=CCNc1ccc(cc1Br)C 34a_100000210942_100015514636 [0,1,1,0,0,0|0,0,2]=4 1137 B12R1.69 C=CCNc1ccc(cc1C)C 34a_100000736561_100015514636 [0,1,1,0,0,0|0,0,2]=4 1138 B12R1.69 C=CCNc1ccc(cc1C)C 7a_100000736561_100015514636 [0,1,1,0,0,0|0,0,2]=4 1139 B12R1.69 C=CCNc1ccc(cc1Cl)C 34a_100000210522_100015514636 [0,1,1,0,0,0|0,0,2]=4 1140 B12R1.69 C=CCNc1ccc(cc1F)C 34a_100000211023_100015514636 [0,1,1,0,0,0|0,0,2]=4 1141 B12R1.69 C=CCNc1ccc(cc1I)C 34a_100011356834_100015514636 [0,1,1,0,0,0|0,0,2]=4 1142 B12R1.69 C=CCNc1ccc(cc1O)C 34a_100000211527_100015514636 [0,1,1,0,0,0|0,0,2]=4 1143 B12R1.69 C=CCOc1ccc(cc1Br)C 34a_100000210800_100015514636 [0,1,1,0,0,0|1,0,1]=4 1144 B12R1.69 C=CCOc1ccc(cc1Br)C 7a_100000210800_100015514636 [0,1,1,0,0,0|1,0,1]=4 1145 B12R1.69 C=CCOc1ccc(cc1C)C 34a_100000211776_100015514636 [0,1,1,0,0,0|1,0,1]=4 1146 B12R1.69 C=CCOc1ccc(cc1C)C 7a_100000211776_100015514636 [0,1,1,0,0,0|1,0,1]=4 1147 B12R1.69 C=CCOc1ccc(cc1Cl)C 34a_100000749699_100015514636 [0,1,1,0,0,0|1,0,1]=4 1148 B12R1.69 C=CCOc1ccc(cc1Cl)C 7a_100000749699_100015514636 [0,1,1,0,0,0|1,0,1]=4 1149 B12R1.69 C=CCOc1ccc(cc1F)C 34a_100011216688_100015514636 [0,1,1,0,0,0|1,0,1]=4 1150 B12R1.69 C=CCOc1ccc(cc1F)C 7a_100011216688_100015514636 [0,1,1,0,0,0|1,0,1]=4 1151 B12R1.69 C=CCOc1ccc(cc1I)C 34a_100000765521_100015514636 [0,1,1,0,0,0|1,0,1]=4 1152 B12R1.69 C=CCOc1ccc(cc1I)C 7a_100000765521_100015514636 [0,1,1,0,0,0|1,0,1]=4 1153 B12R1.69 C=CCOc1ccc(cc1N)C 34a_100011215204_100015514636 [0,1,1,0,0,0|1,0,1]=4 1154 B12R1.69 C=CCOc1ccc(cc1N)C 7a_100011215204_100015514636 [0,1,1,0,0,0|1,0,1]=4 1155 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100000210623_100009813563 [0,1,1,0,0,0|1,0,1]=4 1156 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100009813563_100000210623 [0,1,1,0,0,0|1,0,1]=4 1157 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100000210623_100011217332 [0,1,1,0,0,0|1,0,1]=4 1158 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100011217332_100000210623 [0,1,1,0,0,0|1,0,1]=4 1159 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100000210623_100011263221 [0,1,1,0,0,0|1,0,1]=4 1160 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100011263221_100000210623 [0,1,1,0,0,0|1,0,1]=4 1161 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100000210623_100011216119 [0,1,1,0,0,0|1,0,1]=4 1162 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100011216119_100000210623 [0,1,1,0,0,0|1,0,1]=4 1163 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100000210623_100011216686 [0,1,1,0,0,0|1,0,1]=4 1164 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100011216686_100000210623 [0,1,1,0,0,0|1,0,1]=4 1165 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100000210623_100012002257 [0,1,1,0,0,0|1,0,1]=4 1166 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100012002257_100000210623 [0,1,1,0,0,0|1,0,1]=4 1167 B12R1.71 C=CCNc1ccc(cc1)CC 2230a_100000211069_100000210623 [0,1,1,0,0,0|0,0,2]=4 1168 B12R1.71 C=CCNc1ccc(cc1)CC 34a_100000211069_100015514636 [0,1,1,0,0,0|0,0,2]=4 1169 B12R1.71 C=CCNc1ccc(cc1)CO 2230a_100011215238_100000210623 [0,1,1,0,0,0|0,0,2]=4 1170 B12R1.71 C=CCNc1ccc(cc1)CO 34a_100011215238_100015514636 [0,1,1,0,0,0|0,0,2]=4 1171 B12R1.71 C=CCNc1ccc(cc1)OC 34a_100000184247_100015514636 [0,1,1,0,0,0|0,0,2]=4 1172 B12R1.71 C=CCNc1ccc(cc1)SC 34a_100000212337_100015514636 [0,1,1,0,0,0|0,0,2]=4 1173 B12R1.71 C=CCOc1ccc(cc1)CC 34a_100000211359_100015514636 [0,1,1,0,0,0|1,0,1]=4 1174 B12R1.71 C=CCOc1ccc(cc1)CC 7a_100000211359_100015514636 [0,1,1,0,0,0|1,0,1]=4 1175 B12R1.71 C=CCOc1ccc(cc1)CN 34a_100000185549_100015514636 [0,1,1,0,0,0|1,0,1]=4 1176 B12R1.71 C=CCOc1ccc(cc1)CO 34a_100000211755_100015514636 [0,1,1,0,0,0|1,0,1]=4 1177 B12R1.71 C=CCOc1ccc(cc1)NC 34a_100000182112_100015514636 [0,1,1,0,0,0|1,0,1]=4 1178 B12R1.71 C=CCOc1ccc(cc1)OC 34a_100000210503_100015514636 [0,1,1,0,0,0|1,0,1]=4 1179 B12R1.71 C=CCOc1ccc(cc1)SC 34a_100000211864_100015514636 [0,1,1,0,0,0|1,0,1]=4 1180 B12R1.71 C=CCOc1ccc(cc1)SC 62a_100000172055_200000210301 [0,1,1,0,0,0|1,0,1]=4 1181 B12R1.71 C=CCOc1ccc(cc1)SC 62a_200000210301_100000172055 [0,1,1,0,0,0|1,0,1]=4 1182 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_100000172055_200025704644 [0,1,1,0,0,0|1,0,1]=4 1183 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000172055 [0,1,1,0,0,0|1,0,1]=4 1184 B12R1.71 C=CCSc1ccc(cc1)CC 62a_100000210623_100011215824 [0,1,1,0,0,0|1,0,1]=4 1185 B12R1.71 C=CCSc1ccc(cc1)CC 62a_100011215824_100000210623 [0,1,1,0,0,0|1,0,1]=4 1186 B12R1.71 C=CCSc1ccc(cc1)CF 62a_100000210623_100010268989 [0,1,1,0,0,0|1,0,1]=4 1187 B12R1.71 C=CCSc1ccc(cc1)CF 62a_100010268989_100000210623 [0,1,1,0,0,0|1,0,1]=4 1188 B12R1.71 C=CCSc1ccc(cc1)CN 62a_100000210623_100016989417 [0,1,1,0,0,0|1,0,1]=4 1189 B12R1.71 C=CCSc1ccc(cc1)CN 62a_100016989417_100000210623 [0,1,1,0,0,0|1,0,1]=4 1190 B12R1.71 C=CCSc1ccc(cc1)CO 62a_100000210623_100000690907 [0,1,1,0,0,0|1,0,1]=4 1191 B12R1.71 C=CCSc1ccc(cc1)CO 62a_100000690907_100000210623 [0,1,1,0,0,0|1,0,1]=4 1192 B12R1.71 C=CCSc1ccc(cc1)NC 62a_100000210623_100000743151 [0,1,1,0,0,0|1,0,1]=4 1193 B12R1.71 C=CCSc1ccc(cc1)NC 62a_100000743151_100000210623 [0,1,1,0,0,0|1,0,1]=4 1194 B12R1.71 C=CCSc1ccc(cc1)OC 62a_100000210623_100000171711 [0,1,1,0,0,0|1,0,1]=4 1195 B12R1.71 C=CCSc1ccc(cc1)SC 62a_100000210623_100011263217 [0,1,1,0,0,0|1,0,1]=4 1196 B12R1.71 C=CCSc1ccc(cc1)SC 62a_100011263217_100000210623 [0,1,1,0,0,0|1,0,1]=4 1197 B12R1.71 CSc1ccc(cc1)/C=C/C=O 62a_100016291818_200000210301 [0,1,1,0,0,0|2,0,0]=4 1198 B12R1.71 CSc1ccc(cc1)/C=C/C=O 62a_200000210301_100016291818 [0,1,1,0,0,0|2,0,0]=4 1199 B12R1.71 [13CH3]Sc1ccc(cc1)/C=C/C=O 62a_100016291818_200025704644 [0,1,1,0,0,0|2,0,0]=4 1200 B12R1.71 [13CH3]Sc1ccc(cc1)/C=C/C=O 62a_200025704644_100016291818 [0,1,1,0,0,0|2,0,0]=4 1201 B12R1.385 C=CCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210623 [0,1,1,0,0,0|0,0,2]=4 1202 B12R1.385 C=CCNc1ccc(c(c1)Br)C 34a_100000736455_100015514636 [0,1,1,0,0,0|0,0,2]=4 1203 B12R1.385 C=CCNc1ccc(c(c1)Br)C 7a_100000736455_100015514636 [0,1,1,0,0,0|0,0,2]=4 1204 B12R1.385 C=CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210623 [0,1,1,0,0,0|0,0,2]=4 1205 B12R1.385 C=CCNc1ccc(c(c1)C)C 34a_100000724040_100015514636 [0,1,1,0,0,0|0,0,2]=4 1206 B12R1.385 C=CCNc1ccc(c(c1)C)C 7a_100000724040_100015514636 [0,1,1,0,0,0|0,0,2]=4 1207 B12R1.385 C=CCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210623 [0,1,1,0,0,0|0,0,2]=4 1208 B12R1.385 C=CCNc1ccc(c(c1)Cl)C 34a_100000188892_100015514636 [0,1,1,0,0,0|0,0,2]=4 1209 B12R1.385 C=CCNc1ccc(c(c1)Cl)C 7a_100000188892_100015514636 [0,1,1,0,0,0|0,0,2]=4 1210 B12R1.385 C=CCNc1ccc(c(c1)F)C 2230a_100000210958_100000210623 [0,1,1,0,0,0|0,0,2]=4 1211 B12R1.385 C=CCNc1ccc(c(c1)F)C 34a_100000210958_100015514636 [0,1,1,0,0,0|0,0,2]=4 1212 B12R1.385 C=CCNc1ccc(c(c1)F)C 7a_100000210958_100015514636 [0,1,1,0,0,0|0,0,2]=4 1213 B12R1.385 C=CCNc1ccc(c(c1)I)C 34a_100000184131_100015514636 [0,1,1,0,0,0|0,0,2]=4 1214 B12R1.385 C=CCNc1ccc(c(c1)I)C 7a_100000184131_100015514636 [0,1,1,0,0,0|0,0,2]=4 1215 B12R1.385 C=CCNc1ccc(c(c1)O)C 34a_100000759471_100015514636 [0,1,1,0,0,0|0,0,2]=4 1216 B12R1.385 C=CCNc1ccc(c(c1)O)C 7a_100000759471_100015514636 [0,1,1,0,0,0|0,0,2]=4 1217 B12R1.385 C=CCOc1ccc(c(c1)Br)C 34a_100011380479_100015514636 [0,1,1,0,0,0|1,0,1]=4 1218 B12R1.385 C=CCOc1ccc(c(c1)Br)C 7a_100011380479_100015514636 [0,1,1,0,0,0|1,0,1]=4 1219 B12R1.385 C=CCOc1ccc(c(c1)C)C 34a_100000210932_100015514636 [0,1,1,0,0,0|1,0,1]=4 1220 B12R1.385 C=CCOc1ccc(c(c1)C)C 7a_100000210932_100015514636 [0,1,1,0,0,0|1,0,1]=4 1221 B12R1.385 C=CCOc1ccc(c(c1)Cl)C 34a_100011265682_100015514636 [0,1,1,0,0,0|1,0,1]=4 1222 B12R1.385 C=CCOc1ccc(c(c1)Cl)C 7a_100011265682_100015514636 [0,1,1,0,0,0|1,0,1]=4 1223 B12R1.385 C=CCOc1ccc(c(c1)F)C 34a_100000722560_100015514636 [0,1,1,0,0,0|1,0,1]=4 1224 B12R1.385 C=CCOc1ccc(c(c1)F)C 7a_100000722560_100015514636 [0,1,1,0,0,0|1,0,1]=4 1225 B12R1.385 C=CCOc1ccc(c(c1)N)C 34a_100011216113_100015514636 [0,1,1,0,0,0|1,0,1]=4 1226 B12R1.385 C=CCOc1ccc(c(c1)N)C 7a_100011216113_100015514636 [0,1,1,0,0,0|1,0,1]=4 1227 B12R1.385 C=CCSc1ccc(c(c1)Br)C 62a_100000210623_100011847877 [0,1,1,0,0,0|1,0,1]=4 1228 B12R1.385 C=CCSc1ccc(c(c1)Br)C 62a_100011847877_100000210623 [0,1,1,0,0,0|1,0,1]=4 1229 B12R1.385 C=CCSc1ccc(c(c1)C)C 62a_100000210623_100011215607 [0,1,1,0,0,0|1,0,1]=4 1230 B12R1.385 C=CCSc1ccc(c(c1)C)C 62a_100011215607_100000210623 [0,1,1,0,0,0|1,0,1]=4 1231 B12R1.385 C=CCSc1ccc(c(c1)Cl)C 62a_100000210623_100011216363 [0,1,1,0,0,0|1,0,1]=4 1232 B12R1.385 C=CCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210623 [0,1,1,0,0,0|1,0,1]=4 1233 B12R1.385 C=CCSc1ccc(c(c1)F)C 62a_100000210623_100000720648 [0,1,1,0,0,0|1,0,1]=4 1234 B12R1.385 C=CCSc1ccc(c(c1)F)C 62a_100000720648_100000210623 [0,1,1,0,0,0|1,0,1]=4 1235 B12R1.385 C=CCSc1ccc(c(c1)N)C 62a_100000210623_100000761890 [0,1,1,0,0,0|1,0,1]=4 1236 B12R1.385 C=CCSc1ccc(c(c1)N)C 62a_100000761890_100000210623 [0,1,1,0,0,0|1,0,1]=4 1237 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000210623_100000685420 [0,1,1,0,0,0|1,0,1]=4 1238 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000685420_100000210623 [0,1,1,0,0,0|1,0,1]=4 1239 B12R1.125 CC(=O)C=Cc1ccccc1Br 1458a_100000719032_200000210301 [0,1,1,0,0,0|2,0,0]=4 1240 B12R1.125 CC(=O)C=Cc1ccccc1Cl 1458a_100000720304_200000210301 [0,1,1,0,0,0|2,0,0]=4 1241 B12R1.125 CC(=O)C=Cc1ccccc1F 1458a_100016256065_200000210301 [0,1,1,0,0,0|2,0,0]=4 1242 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,1,1,0,0,0|2,0,0]=4 1243 B12R1.125 CC(C)C=Cc1ncccc1Br 271570a_100016257149_100000696092 [0,1,1,0,0,0|1,0,1]=4 1244 B12R1.125 CC(C)C=Cc1ncccc1Cl 271570a_100016257149_100011356963 [0,1,1,0,0,0|1,0,1]=4 1245 B12R1.125 CC(C)C=Cc1ncccc1F 271570a_100016257149_100000685392 [0,1,1,0,0,0|1,0,1]=4 1246 B12R1.125 CC(C)C=Cc1ncccc1N 271570a_100016257149_100000688686 [0,1,1,0,0,0|1,0,1]=4 1247 B12R1.125 CC(C)C=Cc1ncccc1O 271570a_100016257149_100000034122 [0,1,1,0,0,0|1,0,1]=4 1248 B12R1.125 CC(O)C=Cc1ncccc1Br 271570a_200011019289_100000696092 [0,1,1,0,0,0|1,0,1]=4 1249 B12R1.125 CC(O)C=Cc1ncccc1Cl 271570a_200011019289_100011356963 [0,1,1,0,0,0|1,0,1]=4 1250 B12R1.125 CC(O)C=Cc1ncccc1F 271570a_200011019289_100000685392 [0,1,1,0,0,0|1,0,1]=4 1251 B12R1.125 CC(O)C=Cc1ncccc1N 271570a_200011019289_100000688686 [0,1,1,0,0,0|1,0,1]=4 1252 B12R1.125 CC(O)C=Cc1ncccc1O 271570a_200011019289_100000034122 [0,1,1,0,0,0|1,0,1]=4 1253 B12R1.125 Cc1cccnc1C=CC(C)C 271570a_100016257149_100000751373 [0,1,1,0,0,0|0,0,2]=4 1254 B12R1.125 Cc1cccnc1C=CC(C)O 271570a_200011019289_100000751373 [0,1,1,0,0,0|0,0,2]=4 1255 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Br 1458a_100000719032_200025704644 [0,1,1,0,0,0|2,0,0]=4 1256 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Cl 1458a_100000720304_200025704644 [0,1,1,0,0,0|2,0,0]=4 1257 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1F 1458a_100016256065_200025704644 [0,1,1,0,0,0|2,0,0]=4 1258 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,1,1,0,0,0|2,0,0]=4 1259 B12R1.267 C/C=C/COc1ncccc1Cl 34a_100011290957_100102629194 [0,1,1,0,0,0|1,0,1]=4 1260 B12R1.267 C/C=C/COc1ncccc1F 34a_100011219419_100102629194 [0,1,1,0,0,0|1,0,1]=4 1261 B12R1.267 C/C=C/COc1ncccc1N 34a_100000746358_100102629194 [0,1,1,0,0,0|1,0,1]=4 1262 B12R1.267 C/C=C/CSc1ncccc1Br 62a_100000696092_100102629194 [0,1,1,0,0,0|1,0,1]=4 1263 B12R1.267 C/C=C/CSc1ncccc1Br 62a_100102629194_100000696092 [0,1,1,0,0,0|1,0,1]=4 1264 B12R1.267 C/C=C/CSc1ncccc1C 62a_100000751373_100102629194 [0,1,1,0,0,0|0,0,2]=4 1265 B12R1.267 C/C=C/CSc1ncccc1C 62a_100102629194_100000751373 [0,1,1,0,0,0|0,0,2]=4 1266 B12R1.267 C/C=C/CSc1ncccc1Cl 62a_100011356963_100102629194 [0,1,1,0,0,0|1,0,1]=4 1267 B12R1.267 C/C=C/CSc1ncccc1Cl 62a_100102629194_100011356963 [0,1,1,0,0,0|1,0,1]=4 1268 B12R1.267 C/C=C/CSc1ncccc1F 62a_100000685392_100102629194 [0,1,1,0,0,0|1,0,1]=4 1269 B12R1.267 C/C=C/CSc1ncccc1F 62a_100102629194_100000685392 [0,1,1,0,0,0|1,0,1]=4 1270 B12R1.267 C/C=C/CSc1ncccc1N 62a_100000688686_100102629194 [0,1,1,0,0,0|1,0,1]=4 1271 B12R1.267 C/C=C/CSc1ncccc1N 62a_100102629194_100000688686 [0,1,1,0,0,0|1,0,1]=4 1272 B12R1.267 C/C=C/CSc1ncccc1O 62a_100000034122_100102629194 [0,1,1,0,0,0|1,0,1]=4 1273 B12R1.267 C/C=C/CSc1ncccc1O 62a_100102629194_100000034122 [0,1,1,0,0,0|1,0,1]=4 1274 B12R1.267 CC=CCOc1ncccc1Cl 34a_100011290957_100000070051 [0,1,1,0,0,0|1,0,1]=4 1275 B12R1.267 CC=CCOc1ncccc1F 34a_100011219419_100000070051 [0,1,1,0,0,0|1,0,1]=4 1276 B12R1.267 CC=CCOc1ncccc1N 34a_100000746358_100000070051 [0,1,1,0,0,0|1,0,1]=4 1277 B12R1.267 CC=CCSc1ncccc1Br 62a_100000070051_100000696092 [0,1,1,0,0,0|1,0,1]=4 1278 B12R1.267 CC=CCSc1ncccc1Br 62a_100000696092_100000070051 [0,1,1,0,0,0|1,0,1]=4 1279 B12R1.267 CC=CCSc1ncccc1C 62a_100000070051_100000751373 [0,1,1,0,0,0|0,0,2]=4 1280 B12R1.267 CC=CCSc1ncccc1C 62a_100000751373_100000070051 [0,1,1,0,0,0|0,0,2]=4 1281 B12R1.267 CC=CCSc1ncccc1Cl 62a_100000070051_100011356963 [0,1,1,0,0,0|1,0,1]=4 1282 B12R1.267 CC=CCSc1ncccc1Cl 62a_100011356963_100000070051 [0,1,1,0,0,0|1,0,1]=4 1283 B12R1.267 CC=CCSc1ncccc1F 62a_100000070051_100000685392 [0,1,1,0,0,0|1,0,1]=4 1284 B12R1.267 CC=CCSc1ncccc1F 62a_100000685392_100000070051 [0,1,1,0,0,0|1,0,1]=4 1285 B12R1.267 CC=CCSc1ncccc1N 62a_100000070051_100000688686 [0,1,1,0,0,0|1,0,1]=4 1286 B12R1.267 CC=CCSc1ncccc1N 62a_100000688686_100000070051 [0,1,1,0,0,0|1,0,1]=4 1287 B12R1.267 CC=CCSc1ncccc1O 62a_100000034122_100000070051 [0,1,1,0,0,0|1,0,1]=4 1288 B12R1.267 CC=CCSc1ncccc1O 62a_100000070051_100000034122 [0,1,1,0,0,0|1,0,1]=4 1289 B12R1.267 CCCC=Cc1ncccc1Br 271570a_100016258520_100000696092 [0,1,1,0,0,0|1,0,1]=4 1290 B12R1.267 CCCC=Cc1ncccc1C 271570a_100016258520_100000751373 [0,1,1,0,0,0|0,0,2]=4 1291 B12R1.267 CCCC=Cc1ncccc1Cl 271570a_100016258520_100011356963 [0,1,1,0,0,0|1,0,1]=4 1292 B12R1.267 CCCC=Cc1ncccc1F 271570a_100016258520_100000685392 [0,1,1,0,0,0|1,0,1]=4 1293 B12R1.267 CCCC=Cc1ncccc1N 271570a_100016258520_100000688686 [0,1,1,0,0,0|1,0,1]=4 1294 B12R1.267 CCCC=Cc1ncccc1O 271570a_100016258520_100000034122 [0,1,1,0,0,0|1,0,1]=4 1295 B12R1.267 CCOC=Cc1ncccc1Br 271570a_100016256518_100000696092 [0,1,1,0,0,0|1,0,1]=4 1296 B12R1.267 CCOC=Cc1ncccc1C 271570a_100016256518_100000751373 [0,1,1,0,0,0|0,0,2]=4 1297 B12R1.267 CCOC=Cc1ncccc1Cl 271570a_100016256518_100011356963 [0,1,1,0,0,0|1,0,1]=4 1298 B12R1.267 CCOC=Cc1ncccc1F 271570a_100016256518_100000685392 [0,1,1,0,0,0|1,0,1]=4 1299 B12R1.267 CCOC=Cc1ncccc1N 271570a_100016256518_100000688686 [0,1,1,0,0,0|1,0,1]=4 1300 B12R1.267 CCOC=Cc1ncccc1O 271570a_100016256518_100000034122 [0,1,1,0,0,0|1,0,1]=4 1301 B12R1.267 COCC=Cc1ncccc1Br 271570a_100016286323_100000696092 [0,1,1,0,0,0|1,0,1]=4 1302 B12R1.267 COCC=Cc1ncccc1C 271570a_100016286323_100000751373 [0,1,1,0,0,0|0,0,2]=4 1303 B12R1.267 COCC=Cc1ncccc1Cl 271570a_100016286323_100011356963 [0,1,1,0,0,0|1,0,1]=4 1304 B12R1.267 COCC=Cc1ncccc1F 271570a_100016286323_100000685392 [0,1,1,0,0,0|1,0,1]=4 1305 B12R1.267 COCC=Cc1ncccc1N 271570a_100016286323_100000688686 [0,1,1,0,0,0|1,0,1]=4 1306 B12R1.267 COCC=Cc1ncccc1O 271570a_100016286323_100000034122 [0,1,1,0,0,0|1,0,1]=4 1307 B12R1.17 C=CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210623 [0,1,1,0,0,0|1,0,1]=4 1308 B12R1.28 C/C=C/CNc1cccc(c1)C 34a_100000188690_100102629194 [0,1,1,0,0,0|1,0,1]=4 1309 B12R1.28 C/C=C/COc1cccc(c1)C 34a_100000210337_100102629194 [0,1,1,0,0,0|1,0,1]=4 1310 B12R1.28 C/C=C/COc1cccc(c1)C 7a_100000210337_100102629194 [0,1,1,0,0,0|1,0,1]=4 1311 B12R1.28 C/C=C/CSc1cccc(c1)C 62a_100011215228_100102629194 [0,1,1,0,0,0|1,0,1]=4 1312 B12R1.28 C/C=C/CSc1cccc(c1)C 62a_100102629194_100011215228 [0,1,1,0,0,0|1,0,1]=4 1313 B12R1.28 CC=CCNc1cccc(c1)C 2230a_100000188690_100000070051 [0,1,1,0,0,0|1,0,1]=4 1314 B12R1.28 CC=CCNc1cccc(c1)C 34a_100000188690_100000070051 [0,1,1,0,0,0|1,0,1]=4 1315 B12R1.28 CC=CCOc1cccc(c1)C 34a_100000210337_100000070051 [0,1,1,0,0,0|1,0,1]=4 1316 B12R1.28 CC=CCOc1cccc(c1)C 7a_100000210337_100000070051 [0,1,1,0,0,0|1,0,1]=4 1317 B12R1.28 CC=CCSc1cccc(c1)C 62a_100000070051_100011215228 [0,1,1,0,0,0|1,0,1]=4 1318 B12R1.28 CC=CCSc1cccc(c1)C 62a_100011215228_100000070051 [0,1,1,0,0,0|1,0,1]=4 1319 B12R1.28 CCCC=Cc1cccc(c1)C 271570a_100016258520_100011215228 [0,1,1,0,0,0|1,0,1]=4 1320 B12R1.28 CCOC=Cc1cccc(c1)C 271570a_100016256518_100011215228 [0,1,1,0,0,0|1,0,1]=4 1321 B12R1.28 CNCC=Cc1cccc(c1)C 270004a_106832991635_100102525846 [0,1,1,0,0,0|0,0,2]=4 1322 B12R1.28 COCC=Cc1cccc(c1)C 271570a_100016286323_100011215228 [0,1,1,0,0,0|1,0,1]=4 1323 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,1,1,0,0,0|1,0,1]=4 1324 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,1,1,0,0,0|2,0,0]=4 1325 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,1,1,0,0,0|2,0,0]=4 1326 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [0,1,1,0,0,0|2,0,0]=4 1327 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [0,1,1,0,0,0|2,0,0]=4 1328 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,1,1,0,0,0|1,0,0]=3 1329 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [0,1,1,0,0,0|2,0,0]=4 1330 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [0,1,1,0,0,0|2,0,0]=4 1331 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [0,1,1,0,0,0|2,0,0]=4 1332 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,1,1,0,0,0|1,0,0]=3 1333 B12R1.226 Cc1cccc(c1)C=CC(C)C 271570a_100016257149_100011215228 [0,1,1,0,0,0|1,0,1]=4 1334 B12R1.226 Cc1cccc(c1)C=CC(C)O 271570a_200011019289_100011215228 [0,1,1,0,0,0|1,0,1]=4 1335 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [0,1,1,0,0,0|2,0,0]=4 1336 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [0,1,1,0,0,0|2,0,0]=4 1337 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [0,1,1,0,0,0|2,0,0]=4 1338 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [0,1,1,0,0,0|2,0,0]=4 1339 B12R1.46 C=C(C)c1cc(ccc1C#N)C 271570a_100000694244_100000693804 [0,1,1,0,0,0|2,0,0]=4 1340 B12R1.46 C=C(C)c1cc(ccc1C=O)C 271570a_100000694244_100000692596 [0,1,1,0,0,0|2,0,0]=4 1341 B12R1.46 C=C(C)c1cc(ccc1NC)C 271570a_100000694244_100000221369 [0,1,1,0,0,0|0,0,2]=4 1342 B12R1.46 C=C(C)c1cc(ccc1NN)C 271570a_100000694244_100016996181 [0,1,1,0,0,0|1,0,1]=4 1343 B12R1.46 C=C(C)c1cc(ccc1OC)C 271570a_100000694244_100000186399 [0,1,1,0,0,0|1,0,1]=4 1344 B12R1.46 C=C(C)c1cc(ccc1SC)C 271570a_100000694244_200010201864 [0,1,1,0,0,0|1,0,1]=4 1345 B12R1.46 C=Cc1ccc(cc1C(=O)C)C 271570a_100011290941_100012361225 [0,1,1,0,0,0|1,0,1]=4 1346 B12R1.46 C=Cc1ccc(cc1C(=O)N)C 271570a_100011290941_200012349609 [0,1,1,0,0,0|2,0,0]=4 1347 B12R1.57 C=C(C)c1ccc(cc1C=O)C 271570a_100000694244_100011551863 [0,1,1,0,0,0|2,0,0]=4 1348 B12R1.57 C=Cc1cc(ccc1B(O)O)C 271570a_100011290941_200011068827 [0,1,1,0,0,0|2,0,0]=4 1349 B12R1.57 C=Cc1cc(ccc1C(=O)C)C 271570a_100011290941_100012353930 [0,1,1,0,0,0|1,0,1]=4 1350 B12R1.57 C=Cc1cc(ccc1N(C)C)C 271570a_100011290941_100012353700 [0,1,1,0,0,0|0,0,2]=4 1351 B12R1.78 C=Cc1cc(ccc1C#N)CC 271570a_100011290941_100010295696 [0,1,1,0,0,0|2,0,0]=4 1352 B12R1.78 C=Cc1cc(ccc1C#N)CO 271570a_100011290941_100009876504 [0,1,1,0,0,0|2,0,0]=4 1353 B12R1.78 C=Cc1cc(ccc1C#N)OC 271570a_100011290941_100012355471 [0,1,1,0,0,0|2,0,0]=4 1354 B12R1.78 C=Cc1cc(ccc1C=O)OC 271570a_100011290941_100000723261 [0,1,1,0,0,0|2,0,0]=4 1355 B12R1.78 C=Cc1cc(ccc1CO)CO 271570a_100011290941_100010881536 [0,1,1,0,0,0|2,0,0]=4 1356 B12R1.78 C=Cc1cc(ccc1CO)OC 271570a_100011290941_100011982768 [0,1,1,0,0,0|2,0,0]=4 1357 B12R1.78 C=Cc1cc(ccc1OC)CC 271570a_100011290941_100010062400 [0,1,1,0,0,0|1,0,1]=4 1358 B12R1.78 C=Cc1cc(ccc1OC)CN 271570a_100011290941_100159240714 [0,1,1,0,0,0|1,0,1]=4 1359 B12R1.78 C=Cc1cc(ccc1OC)CO 271570a_100011290941_100000246451 [0,1,1,0,0,0|1,0,1]=4 1360 B12R1.78 C=Cc1cc(ccc1OC)NC 271570a_100011290941_114948341033 [0,1,1,0,0,0|1,0,1]=4 1361 B12R1.78 C=Cc1cc(ccc1OC)OC 271570a_100011290941_100011215452 [0,1,1,0,0,0|1,0,1]=4 1362 B12R1.78 C=Cc1ccc(cc1C=O)OC 271570a_100011290941_100000691568 [0,1,1,0,0,0|2,0,0]=4 1363 B12R1.112 C=C=Cc1ccc(cc1C=O)C 271570a_100015277604_100011551863 [0,1,1,0,0,0|2,0,0]=4 1364 B12R1.112 C=Cc1cc(ccc1OCC)C 271570a_100011290941_200000230997 [0,1,1,0,0,0|1,0,1]=4 1365 B12R1.112 CC=Cc1ccc(cc1C=O)C 271570a_100016259895_100011551863 [0,1,1,0,0,0|2,0,0]=4 1366 B12R1.234 C=Cc1cc(cc(c1C#N)F)C 271570a_100011290941_100016215262 [0,1,1,0,0,0|2,0,0]=4 1367 B12R1.234 C=Cc1cc(cc(c1C=O)F)C 271570a_100011290941_100010341274 [0,1,1,0,0,0|2,0,0]=4 1368 B12R1.234 C=Cc1cc(cc(c1CO)F)C 271570a_100011290941_100016175008 [0,1,1,0,0,0|2,0,0]=4 1369 B12R1.234 C=Cc1cc(cc(c1OC)F)C 271570a_100011290941_200010713180 [0,1,1,0,0,0|1,0,1]=4 1370 B12R1.234 C=Cc1cc(cc(c1SC)F)C 271570a_100011290941_202125771776 [0,1,1,0,0,0|1,0,1]=4 1371 B12R1.268 C=C=Cc1cc(ccc1C#N)C 271570a_100015277604_100000693804 [0,1,1,0,0,0|2,0,0]=4 1372 B12R1.268 C=C=Cc1cc(ccc1C=O)C 271570a_100015277604_100000692596 [0,1,1,0,0,0|2,0,0]=4 1373 B12R1.268 C=C=Cc1cc(ccc1NC)C 271570a_100015277604_100000221369 [0,1,1,0,0,0|0,0,2]=4 1374 B12R1.268 C=C=Cc1cc(ccc1NN)C 271570a_100015277604_100016996181 [0,1,1,0,0,0|1,0,1]=4 1375 B12R1.268 C=C=Cc1cc(ccc1OC)C 271570a_100015277604_100000186399 [0,1,1,0,0,0|1,0,1]=4 1376 B12R1.268 C=C=Cc1cc(ccc1SC)C 271570a_100015277604_200010201864 [0,1,1,0,0,0|1,0,1]=4 1377 B12R1.268 CC=Cc1cc(ccc1C#N)C 271570a_100016259895_100000693804 [0,1,1,0,0,0|2,0,0]=4 1378 B12R1.268 CC=Cc1cc(ccc1C=O)C 271570a_100016259895_100000692596 [0,1,1,0,0,0|2,0,0]=4 1379 B12R1.268 CC=Cc1cc(ccc1NC)C 271570a_100016259895_100000221369 [0,1,1,0,0,0|0,0,2]=4 1380 B12R1.268 CC=Cc1cc(ccc1NN)C 271570a_100016259895_100016996181 [0,1,1,0,0,0|1,0,1]=4 1381 B12R1.268 CC=Cc1cc(ccc1OC)C 271570a_100016259895_100000186399 [0,1,1,0,0,0|1,0,1]=4 1382 B12R1.268 CC=Cc1cc(ccc1SC)C 271570a_100016259895_200010201864 [0,1,1,0,0,0|1,0,1]=4 1383 B12R1.448 C=Cc1cc(c(cc1C#N)F)C 271570a_100011290941_100010186300 [0,1,1,0,0,0|2,0,0]=4 1384 B12R1.448 C=Cc1cc(c(cc1C=O)C)C 271570a_100011290941_100010184403 [0,1,1,0,0,0|2,0,0]=4 1385 B12R1.448 C=Cc1cc(c(cc1C=O)C)F 271570a_100011290941_100009814814 [0,1,1,0,0,0|2,0,0]=4 1386 B12R1.448 C=Cc1cc(c(cc1C=O)F)C 271570a_100011290941_100010186290 [0,1,1,0,0,0|2,0,0]=4 1387 B12R1.448 C=Cc1cc(c(cc1C=O)O)C 271570a_100011290941_100010186689 [0,1,1,0,0,0|2,0,0]=4 1388 B12R1.448 C=Cc1cc(c(cc1CO)C)C 271570a_100011290941_100010184405 [0,1,1,0,0,0|2,0,0]=4 1389 B12R1.448 C=Cc1cc(c(cc1OC)F)C 271570a_100011290941_100010201977 [0,1,1,0,0,0|1,0,1]=4 1390 B12R1.448 C=Cc1cc(c(cc1OC)N)C 271570a_100011290941_100010232211 [0,1,1,0,0,0|1,0,1]=4 1391 B12R1.652 C=Cc1ccc(c(c1C=O)F)C 271570a_100011290941_100000039034 [0,1,1,0,0,0|2,0,0]=4 1392 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000210193_100000733263 [0,1,1,0,0,0|1,0,1]=4 1393 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000737805_100000210623 [0,1,1,0,0,0|1,0,1]=4 1394 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000184577_100000210623 [0,1,1,0,0,0|1,0,1]=4 1395 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000201331_200000210301 [0,1,1,0,0,0|1,0,1]=4 1396 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000225617_100000741622 [0,1,1,0,0,0|1,0,1]=4 1397 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000184577_100000210623 [0,1,1,0,0,0|1,0,1]=4 1398 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000201331_200000210301 [0,1,1,0,0,0|1,0,1]=4 1399 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000225617_100000733263 [0,1,1,0,0,0|1,0,1]=4 1400 B12R1.32 C=CCN(C)Cc1cccnc1 270004a_100000225617_100000209961 [0,1,1,0,0,0|1,0,1]=4 1401 B12R1.32 C=CCN([13CH3])Cc1cccnc1 2230a_100000201331_200025704644 [0,1,1,0,0,0|1,0,1]=4 1402 B12R1.32 C=CCN([13CH3])Cc1cccnc1 269982a_100000201331_200025704644 [0,1,1,0,0,0|1,0,1]=4 1403 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,1,1,0,0,0|1,0,1]=4 1404 B12R1.32 O=C(C=CBr)Cc1cccnc1 1458a_100016273825_100000733263 [0,1,1,0,0,0|1,0,1]=4 1405 B12R1.32 O=C(C=CCl)Cc1cccnc1 1458a_200016279998_100000733263 [0,1,1,0,0,0|1,0,1]=4 1406 B12R1.32 O=C(C=CI)Cc1cccnc1 1458a_100016256311_100000733263 [0,1,1,0,0,0|1,0,1]=4 1407 B12R1.43 C/C(=C\c1ccccc1)/C(=O)[13CH3] 1458a_100016990649_200025704644 [0,1,1,0,0,0|1,0,1]=4 1408 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [0,1,1,0,0,0|1,0,1]=4 1409 B12R1.43 CC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_200000210301 [0,1,1,0,0,0|1,0,1]=4 1410 B12R1.43 CC(=O)C(=Cc1cccnc1)F 1458a_100000731744_200000210301 [0,1,1,0,0,0|1,0,1]=4 1411 B12R1.43 [13CH3]C(=O)C(=Cc1cccnc1)F 1458a_100000731744_200025704644 [0,1,1,0,0,0|1,0,1]=4 1412 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,1,1,0,0,0|1,0,1]=4 1413 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [0,1,1,0,0,0|2,0,0]=4 1414 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [0,1,1,0,0,0|2,0,0]=4 1415 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [0,1,1,0,0,0|2,0,0]=4 1416 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [0,1,1,0,0,0|2,0,0]=4 1417 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [0,1,1,0,0,0|2,0,0]=4 1418 B12R1.75 C=Cc1ncccc1OC(=O)C 271570a_100011290941_200009815371 [0,1,1,0,0,0|1,0,0]=3 1419 B12R1.75 CC(=Cc1ccccc1C=O)C 271570a_100102525489_100000211189 [0,1,1,0,0,0|2,0,0]=4 1420 B12R1.75 CC(=Cc1cccnc1C#N)C 271570a_100102525489_100000685805 [0,1,1,0,0,0|1,0,1]=4 1421 B12R1.75 CC(=Cc1cccnc1C=O)C 271570a_100102525489_100011934733 [0,1,1,0,0,0|1,0,0]=3 1422 B12R1.75 CC(=Cc1cccnc1CN)C 271570a_100102525489_100020591323 [0,1,1,0,0,0|1,0,1]=4 1423 B12R1.75 CC(=Cc1cccnc1CO)C 271570a_100102525489_100011996772 [0,1,1,0,0,0|1,0,1]=4 1424 B12R1.75 CC(=Cc1cccnc1NN)C 271570a_100102525489_100011464834 [0,1,1,0,0,0|2,0,0]=4 1425 B12R1.75 CCc1ncccc1C=C(C)C 271570a_100102525489_100009877225 [0,1,1,0,0,0|0,0,2]=4 1426 B12R1.75 CNc1ncccc1C=C(C)C 271570a_100102525489_100000700899 [0,1,1,0,0,0|1,0,1]=4 1427 B12R1.75 COc1ncccc1C=C(C)C 271570a_100102525489_100000047025 [0,1,1,0,0,0|1,0,1]=4 1428 B12R1.75 CSc1ncccc1C=C(C)C 271570a_100102525489_100011465278 [0,1,1,0,0,0|1,0,1]=4 1429 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [0,1,1,0,0,0|1,0,1]=4 1430 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [0,1,1,0,0,0|2,0,0]=4 1431 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [0,1,1,0,0,0|2,0,0]=4 1432 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [0,1,1,0,0,0|2,0,0]=4 1433 B12R1.77 C=Cc1ncccc1C(=O)NC 271570a_100011290941_100000159833 [0,1,1,0,0,0|1,0,0]=3 1434 B12R1.77 C=Cc1ncccc1C(=O)OC 271570a_100011290941_100000150852 [0,1,1,0,0,0|1,0,0]=3 1435 B12R1.77 C=Cc1nccnc1C(=O)OC 271570a_100011290941_100000688410 [0,1,1,0,0,0|2,0,0]=4 1436 B12R1.77 C=Cc1ncncc1C(=O)OC 271570a_100011290941_100000726419 [0,1,1,0,0,0|2,0,0]=4 1437 B12R1.169 C=C=Cc1ncccc1CNC 271570a_100015277604_103496529121 [0,1,1,0,0,0|1,0,1]=4 1438 B12R1.169 C=C=Cc1ncccc1OCC 271570a_100015277604_100011597540 [0,1,1,0,0,0|1,0,1]=4 1439 B12R1.169 C=CCc1ccccc1C=CC 271570a_100016259895_100009828059 [0,1,1,0,0,0|1,0,0]=3 1440 B12R1.169 CC=Cc1cccnc1CC#N 271570a_100016259895_100011824415 [0,1,1,0,0,0|0,0,2]=4 1441 B12R1.169 CC=Cc1cccnc1N=[N+]=[N-] 271570a_100016259895_100012787798 [0,1,1,0,0,0|2,0,0]=4 1442 B12R1.169 CC=Cc1cccnc1OCC 271570a_100016259895_100011465154 [0,1,1,0,0,0|0,0,2]=4 1443 B12R1.169 CC=Cc1ncccc1CNC 271570a_100016259895_103496529121 [0,1,1,0,0,0|1,0,1]=4 1444 B12R1.169 CC=Cc1ncccc1OCC 271570a_100016259895_100011597540 [0,1,1,0,0,0|1,0,1]=4 1445 B12R1.283 C=C(C)c1ncccc1CNC 271570a_100000694244_103496529121 [0,1,1,0,0,0|1,0,1]=4 1446 B12R1.283 C=C(C)c1ncccc1OCC 271570a_100000694244_100011597540 [0,1,1,0,0,0|1,0,1]=4 1447 B12R1.283 CC=Cc1ccccc1C(=O)C 271570a_100016259895_100000751169 [0,1,1,0,0,0|1,0,1]=4 1448 B12R1.283 CC=Cc1ccccc1C(=O)N 271570a_100016259895_100000162227 [0,1,1,0,0,0|2,0,0]=4 1449 B12R1.283 CC=Cc1cccnc1C(=O)C 271570a_100016259895_100012348690 [0,1,1,0,0,0|0,0,1]=3 1450 B12R1.283 CC=Cc1cccnc1C(=O)N 271570a_100016259895_200012359670 [0,1,1,0,0,0|1,0,0]=3 1451 B12R1.283 CC=Cc1cccnc1C(C)N 271570a_100016259895_100159271932 [0,1,1,0,0,0|0,0,2]=4 1452 B12R1.283 CC=Cc1cccnc1C(F)F 271570a_100016259895_100010079810 [0,1,1,0,0,0|1,0,1]=4 1453 B12R1.283 CC=Cc1cccnc1N(C)C 271570a_100016259895_100011465059 [0,1,1,0,0,0|1,0,1]=4 1454 B12R1.283 CC=Cc1cccnc1[C@H](C)O 271570a_100016259895_100013325542 [0,1,1,0,0,0|0,0,2]=4 1455 B12R1.283 CC=Cc1nccnc1C(=O)C 271570a_100016259895_100000099859 [0,1,1,0,0,0|1,0,1]=4 1456 B12R1.283 CC=Cc1nccnc1C(=O)N 271570a_100016259895_100000094861 [0,1,1,0,0,0|2,0,0]=4 1457 B12R1.542 CC=Cc1cccc(c1C=O)C 271570a_100016259895_100000041122 [0,1,1,0,0,0|2,0,0]=4 1458 B12R1.542 CC=Cc1cccc(c1C=O)Cl 271570a_100016259895_100010147682 [0,1,1,0,0,0|2,0,0]=4 1459 B12R1.542 CC=Cc1cccc(c1C=O)F 271570a_100016259895_100000210083 [0,1,1,0,0,0|2,0,0]=4 1460 B12R1.542 CC=Cc1cccc(c1C=O)N 271570a_100016259895_100010232536 [0,1,1,0,0,0|2,0,0]=4 1461 B12R1.542 CC=Cc1cccc(c1C=O)O 271570a_100016259895_100009814793 [0,1,1,0,0,0|2,0,0]=4 1462 B12R1.1112 CC=Cc1c(cccc1C=O)F 271570a_100016259895_100011998484 [0,1,1,0,0,0|2,0,0]=4 1463 B12R1.1112 CC=Cc1c(cccc1C=O)O 271570a_100016259895_100009816417 [0,1,1,0,0,0|2,0,0]=4 1464 B12R1.1112 CC=Cc1c(ccnc1C#N)C 271570a_100016259895_100009878727 [0,1,1,0,0,0|1,0,1]=4 1465 B12R1.1112 CC=Cc1c(ccnc1OC)C 271570a_100016259895_100012353928 [0,1,1,0,0,0|1,0,1]=4 1466 B12R1.1112 CC=Cc1c(ccnc1OC)N 271570a_100016259895_100010243811 [0,1,1,0,0,0|1,0,1]=4 1467 B12R1.124 CC(=C(C)c1cccnc1Br)C 271570a_200000049429_100010202626 [0,1,1,0,0,0|1,0,1]=4 1468 B12R1.124 CC(=C(C)c1cccnc1C)C 271570a_200000049429_100000751574 [0,1,1,0,0,0|0,0,2]=4 1469 B12R1.124 CC(=C(C)c1cccnc1Cl)C 271570a_200000049429_100000036424 [0,1,1,0,0,0|1,0,1]=4 1470 B12R1.124 CC(=C(C)c1cccnc1F)C 271570a_200000049429_100009816115 [0,1,1,0,0,0|1,0,1]=4 1471 B12R1.124 CC(=C(C)c1cccnc1N)C 271570a_200000049429_100000045569 [0,1,1,0,0,0|1,0,1]=4 1472 B12R1.127 CC(=Cc1cc(cnc1Br)N)C 271570a_100102525489_100010201102 [0,1,1,0,0,0|1,0,1]=4 1473 B12R1.127 CC(=Cc1cc(cnc1C)Br)C 271570a_100102525489_200010090566 [0,1,1,0,0,0|0,0,2]=4 1474 B12R1.127 CC(=Cc1cc(cnc1C)C)C 271570a_100102525489_100009817436 [0,1,1,0,0,0|0,0,2]=4 1475 B12R1.127 CC(=Cc1cc(cnc1C)F)C 271570a_100102525489_100009860710 [0,1,1,0,0,0|0,0,2]=4 1476 B12R1.127 CC(=Cc1cc(cnc1C)N)C 271570a_100102525489_100011998591 [0,1,1,0,0,0|0,0,2]=4 1477 B12R1.127 CC(=Cc1cc(cnc1C)O)C 271570a_100102525489_100009819603 [0,1,1,0,0,0|0,0,2]=4 1478 B12R1.127 CC(=Cc1cc(cnc1Cl)Br)C 271570a_100102525489_100009814771 [0,1,1,0,0,0|1,0,1]=4 1479 B12R1.127 CC(=Cc1cc(cnc1Cl)C)C 271570a_100102525489_100010210167 [0,1,1,0,0,0|1,0,1]=4 1480 B12R1.127 CC(=Cc1cc(cnc1Cl)Cl)C 271570a_100102525489_200000062399 [0,1,1,0,0,0|1,0,1]=4 1481 B12R1.127 CC(=Cc1cc(cnc1Cl)N)C 271570a_100102525489_100010253917 [0,1,1,0,0,0|1,0,1]=4 1482 B12R1.127 CC(=Cc1cc(cnc1F)Br)C 271570a_100102525489_100010172738 [0,1,1,0,0,0|1,0,1]=4 1483 B12R1.127 CC(=Cc1cc(cnc1F)C)C 271570a_100102525489_100000049784 [0,1,1,0,0,0|1,0,1]=4 1484 B12R1.127 CC(=Cc1cc(cnc1F)Cl)C 271570a_100102525489_100010188783 [0,1,1,0,0,0|1,0,1]=4 1485 B12R1.127 CC(=Cc1cc(cnc1F)F)C 271570a_100102525489_100009820768 [0,1,1,0,0,0|1,0,1]=4 1486 B12R1.127 CC(=Cc1cc(cnc1F)N)C 271570a_100102525489_100009840397 [0,1,1,0,0,0|1,0,1]=4 1487 B12R1.127 CC(=Cc1cc(cnc1F)O)C 271570a_100102525489_100009817267 [0,1,1,0,0,0|1,0,1]=4 1488 B12R1.127 CC(=Cc1cc(cnc1N)Br)C 271570a_100102525489_100000760472 [0,1,1,0,0,0|1,0,1]=4 1489 B12R1.127 CC(=Cc1cc(cnc1N)C)C 271570a_100102525489_100000049664 [0,1,1,0,0,0|1,0,1]=4 1490 B12R1.127 CC(=Cc1cc(cnc1N)Cl)C 271570a_100102525489_100000050159 [0,1,1,0,0,0|1,0,1]=4 1491 B12R1.127 CC(=Cc1cc(cnc1N)F)C 271570a_100102525489_100009814671 [0,1,1,0,0,0|1,0,1]=4 1492 B12R1.127 CC(=Cc1cc(cnc1N)N)C 271570a_100102525489_200011934315 [0,1,1,0,0,0|1,0,1]=4 1493 B12R1.127 CC(=Cc1cc(cnc1O)Br)C 271570a_100102525489_100010197142 [0,1,1,0,0,0|1,0,1]=4 1494 B12R1.127 CC(=Cc1cc(cnc1O)C)C 271570a_100102525489_100000049931 [0,1,1,0,0,0|1,0,1]=4 1495 B12R1.127 CC(=Cc1cc(cnc1O)Cl)C 271570a_100102525489_100010188700 [0,1,1,0,0,0|1,0,1]=4 1496 B12R1.1009 CC(=Cc1c(ccnc1C)C)C 271570a_100102525489_100012000501 [0,1,1,0,0,0|0,0,2]=4 1497 B12R1.1009 CC(=Cc1c(ccnc1C)N)C 271570a_100102525489_100010243816 [0,1,1,0,0,0|0,0,2]=4 1498 B12R1.1009 CC(=Cc1c(ccnc1F)C)C 271570a_100102525489_100009818256 [0,1,1,0,0,0|1,0,1]=4 1499 B12R1.1009 CC(=Cc1c(ccnc1F)F)C 271570a_100102525489_100009874084 [0,1,1,0,0,0|1,0,1]=4 1500 B12R1.1009 CC(=Cc1c(ccnc1F)N)C 271570a_100102525489_100010381272 [0,1,1,0,0,0|1,0,1]=4 1501 B12R1.1009 CC(=Cc1c(ccnc1N)C)C 271570a_100102525489_100011998619 [0,1,1,0,0,0|1,0,1]=4 1502 B12R1.1009 CC(=Cc1c(ccnc1N)Cl)C 271570a_100102525489_100010199028 [0,1,1,0,0,0|1,0,1]=4 1503 B12R1.1009 CC(=Cc1c(ccnc1O)C)C 271570a_100102525489_100012000493 [0,1,1,0,0,0|1,0,1]=4 1504 B12R1.1009 CC(=Cc1c(ccnc1O)O)C 271570a_100102525489_200009817435 [0,1,1,0,0,0|1,0,1]=4 1505 B12R1.27 C=CC(=NNc1ccccn1)C 4a_100000183288_200015361842 [0,1,1,0,0,0|2,0,0]=4 1506 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [0,1,1,0,0,0|2,0,0]=4 1507 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [0,1,1,0,0,0|1,0,0]=3 1508 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [0,1,1,0,0,0|2,0,0]=4 1509 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [0,1,1,0,0,0|2,0,0]=4 1510 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [0,1,1,0,0,0|1,0,0]=3 1511 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [0,1,1,0,0,0|1,0,0]=3 1512 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [0,1,1,0,0,0|2,0,0]=4 1513 B12R1.27 O=C(C=Cc1ccccn1)CF 1458a_100000740811_100015361967 [0,1,1,0,0,0|1,0,0]=3 1514 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [0,1,1,0,0,0|1,0,1]=4 1515 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [0,1,1,0,0,0|2,0,0]=4 1516 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [0,1,1,0,0,0|2,0,0]=4 1517 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [0,1,1,0,0,0|1,0,1]=4 1518 B12R1.891 CC(C)(C)C=Cc1ccccn1 271570a_100102527731_100011216584 [0,1,1,0,0,0|0,0,2]=4 1519 B12R1.891 CC(C)(O)C=Cc1ccccn1 271570a_200016258132_100011216584 [0,1,1,0,0,0|0,0,2]=4 1520 B12R1.40 C=C=Cc1cc(cc(c1C)F)C 271570a_100015277604_100015473476 [0,1,1,0,0,0|1,0,1]=4 1521 B12R1.40 C=C=Cc1cc(cc(c1C)N)C 271570a_100015277604_102495365385 [0,1,1,0,0,0|1,0,1]=4 1522 B12R1.40 C=C=Cc1cc(cc(c1F)C)C 271570a_100015277604_200010204574 [0,1,1,0,0,0|1,0,1]=4 1523 B12R1.40 C=C=Cc1cc(cc(c1F)F)C 271570a_100015277604_100010141297 [0,1,1,0,0,0|1,0,1]=4 1524 B12R1.40 C=C=Cc1cc(cc(c1F)N)C 271570a_100015277604_100010589139 [0,1,1,0,0,0|1,0,1]=4 1525 B12R1.40 C=C=Cc1cc(cc(c1N)C)C 271570a_100015277604_100000688863 [0,1,1,0,0,0|0,0,2]=4 1526 B12R1.40 C=C=Cc1cc(cc(c1N)F)C 271570a_100015277604_100012353694 [0,1,1,0,0,0|0,0,2]=4 1527 B12R1.40 C=C=Cc1cc(cc(c1N)N)C 271570a_100015277604_100012348275 [0,1,1,0,0,0|0,0,2]=4 1528 B12R1.40 C=C=Cc1cc(cc(c1O)C)C 271570a_100015277604_100011934984 [0,1,1,0,0,0|1,0,1]=4 1529 B12R1.40 C=C=Cc1cc(cc(c1O)F)C 271570a_100015277604_200135191068 [0,1,1,0,0,0|1,0,1]=4 1530 B12R1.40 CC=Cc1cc(cc(c1C)F)C 271570a_100016259895_100015473476 [0,1,1,0,0,0|1,0,1]=4 1531 B12R1.40 CC=Cc1cc(cc(c1C)N)C 271570a_100016259895_102495365385 [0,1,1,0,0,0|1,0,1]=4 1532 B12R1.40 CC=Cc1cc(cc(c1F)C)C 271570a_100016259895_200010204574 [0,1,1,0,0,0|1,0,1]=4 1533 B12R1.40 CC=Cc1cc(cc(c1F)F)C 271570a_100016259895_100010141297 [0,1,1,0,0,0|1,0,1]=4 1534 B12R1.40 CC=Cc1cc(cc(c1F)N)C 271570a_100016259895_100010589139 [0,1,1,0,0,0|1,0,1]=4 1535 B12R1.40 CC=Cc1cc(cc(c1N)C)C 271570a_100016259895_100000688863 [0,1,1,0,0,0|0,0,2]=4 1536 B12R1.40 CC=Cc1cc(cc(c1N)F)C 271570a_100016259895_100012353694 [0,1,1,0,0,0|0,0,2]=4 1537 B12R1.40 CC=Cc1cc(cc(c1N)N)C 271570a_100016259895_100012348275 [0,1,1,0,0,0|0,0,2]=4 1538 B12R1.40 CC=Cc1cc(cc(c1O)C)C 271570a_100016259895_100011934984 [0,1,1,0,0,0|1,0,1]=4 1539 B12R1.40 CC=Cc1cc(cc(c1O)F)C 271570a_100016259895_200135191068 [0,1,1,0,0,0|1,0,1]=4 1540 B12R1.270 C=C=Cc1cc(ccc1Br)OC 271570a_100015277604_100009992028 [0,1,1,0,0,0|1,0,1]=4 1541 B12R1.270 C=C=Cc1cc(ccc1C)CO 271570a_100015277604_100000050133 [0,1,1,0,0,0|1,0,1]=4 1542 B12R1.270 C=C=Cc1cc(ccc1C)NC 271570a_100015277604_100000707694 [0,1,1,0,0,0|1,0,1]=4 1543 B12R1.270 C=C=Cc1cc(ccc1C)OC 271570a_100015277604_100012349166 [0,1,1,0,0,0|1,0,1]=4 1544 B12R1.270 C=C=Cc1cc(ccc1Cl)OC 271570a_100015277604_100011356938 [0,1,1,0,0,0|1,0,1]=4 1545 B12R1.270 C=C=Cc1cc(ccc1F)CC 271570a_100015277604_200010244628 [0,1,1,0,0,0|1,0,1]=4 1546 B12R1.270 C=C=Cc1cc(ccc1F)CN 271570a_100015277604_100015193890 [0,1,1,0,0,0|1,0,1]=4 1547 B12R1.270 C=C=Cc1cc(ccc1F)CO 271570a_100015277604_100000246287 [0,1,1,0,0,0|1,0,1]=4 1548 B12R1.270 C=C=Cc1cc(ccc1F)OC 271570a_100015277604_100000699733 [0,1,1,0,0,0|1,0,1]=4 1549 B12R1.270 C=C=Cc1cc(ccc1F)SC 271570a_100015277604_200010708804 [0,1,1,0,0,0|1,0,1]=4 1550 B12R1.270 C=C=Cc1cc(ccc1N)CC 271570a_100015277604_100012339725 [0,1,1,0,0,0|0,0,2]=4 1551 B12R1.270 C=C=Cc1cc(ccc1N)OC 271570a_100015277604_100015195136 [0,1,1,0,0,0|0,0,2]=4 1552 B12R1.270 C=C=Cc1cc(ccc1O)CC 271570a_100015277604_100012339963 [0,1,1,0,0,0|1,0,1]=4 1553 B12R1.270 C=C=Cc1cc(ccc1O)CO 271570a_100015277604_100011191544 [0,1,1,0,0,0|1,0,1]=4 1554 B12R1.270 C=C=Cc1cc(ccc1O)OC 271570a_100015277604_100000685887 [0,1,1,0,0,0|1,0,1]=4 1555 B12R1.270 CC=Cc1cc(ccc1Br)OC 271570a_100016259895_100009992028 [0,1,1,0,0,0|1,0,1]=4 1556 B12R1.270 CC=Cc1cc(ccc1C)CO 271570a_100016259895_100000050133 [0,1,1,0,0,0|1,0,1]=4 1557 B12R1.270 CC=Cc1cc(ccc1C)NC 271570a_100016259895_100000707694 [0,1,1,0,0,0|1,0,1]=4 1558 B12R1.270 CC=Cc1cc(ccc1C)OC 271570a_100016259895_100012349166 [0,1,1,0,0,0|1,0,1]=4 1559 B12R1.270 CC=Cc1cc(ccc1Cl)OC 271570a_100016259895_100011356938 [0,1,1,0,0,0|1,0,1]=4 1560 B12R1.270 CC=Cc1cc(ccc1F)CC 271570a_100016259895_200010244628 [0,1,1,0,0,0|1,0,1]=4 1561 B12R1.270 CC=Cc1cc(ccc1F)CN 271570a_100016259895_100015193890 [0,1,1,0,0,0|1,0,1]=4 1562 B12R1.270 CC=Cc1cc(ccc1F)CO 271570a_100016259895_100000246287 [0,1,1,0,0,0|1,0,1]=4 1563 B12R1.270 CC=Cc1cc(ccc1F)OC 271570a_100016259895_100000699733 [0,1,1,0,0,0|1,0,1]=4 1564 B12R1.270 CC=Cc1cc(ccc1F)SC 271570a_100016259895_200010708804 [0,1,1,0,0,0|1,0,1]=4 1565 B12R1.270 CC=Cc1cc(ccc1N)CC 271570a_100016259895_100012339725 [0,1,1,0,0,0|0,0,2]=4 1566 B12R1.270 CC=Cc1cc(ccc1N)OC 271570a_100016259895_100015195136 [0,1,1,0,0,0|0,0,2]=4 1567 B12R1.270 CC=Cc1cc(ccc1O)CC 271570a_100016259895_100012339963 [0,1,1,0,0,0|1,0,1]=4 1568 B12R1.270 CC=Cc1cc(ccc1O)CO 271570a_100016259895_100011191544 [0,1,1,0,0,0|1,0,1]=4 1569 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [0,1,1,0,0,0|1,0,1]=4 1570 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [1,1,0,0,0,0|1,0,0]=3 1571 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [1,1,0,0,0,0|0,0,0]=2 1572 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [1,1,0,0,0,0|2,0,0]=4 1573 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [1,1,0,0,0,0|2,0,0]=4 1574 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [1,1,0,0,0,0|1,0,0]=3 1575 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [1,1,0,0,0,0|0,0,0]=2 1576 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [1,1,0,0,0,0|1,0,0]=3 1577 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [1,1,0,0,0,0|1,0,0]=3 1578 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [1,1,0,0,0,0|0,0,0]=2 1579 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [1,1,0,0,0,0|1,0,0]=3 1580 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [1,1,0,0,0,0|1,0,0]=3 1581 B12R2.1081 Oc1ccnc2c1nccn2 271570a_203496583355_100010783457 [1,1,0,0,0,0|2,0,0]=4 1582 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [1,1,0,0,0,0|2,0,0]=4 1583 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [1,1,0,0,0,0|1,0,0]=3 1584 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [1,1,0,0,0,0|2,0,0]=4 1585 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [1,1,0,0,0,0|1,0,0]=3 1586 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [1,1,0,0,0,0|2,0,0]=4 1587 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [1,1,0,0,0,0|1,0,0]=3 1588 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [1,1,0,0,0,0|1,0,0]=3 1589 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [1,1,0,0,0,0|2,0,0]=4 1590 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [1,1,0,0,0,0|1,0,0]=3 1591 B12R2.1081 Oc1ncnc2c1cccn2 271570a_203496583355_100000026734 [1,1,0,0,0,0|2,0,0]=4 1592 B12R2.1081 Oc1ncnc2c1ccnc2 271570a_203496583355_100000098430 [1,1,0,0,0,0|2,0,0]=4 1593 B12R2.1 C=Cc1c[nH]c2c1cccn2 271570a_100011290941_100011934613 [0,1,0,0,1,0|1,0,1]=4 1594 B12R2.1 C=Cc1csc2c1cccn2 271570a_100011290941_100009830249 [0,1,0,0,1,0|1,0,1]=4 1595 B12R2.1 CNc1csc2c1nccn2 27a_100102657272_100010174841 [0,1,0,0,1,0|2,0,0]=4 1596 B12R2.1 CNc1n[nH]c2c1cccn2 27a_100102657272_100009818534 [0,1,0,0,1,0|2,0,0]=4 1597 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,0,1,0|2,0,0]=4 1598 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,0,1,0|2,0,0]=4 1599 B12R2.1 CSc1c[nH]c2c1cccn2 62a_200000210301_100011934613 [0,1,0,0,1,0|1,0,0]=3 1600 B12R2.1 CSc1c[nH]c2c1cncn2 62a_100009817560_200000210301 [0,1,0,0,1,0|2,0,0]=4 1601 B12R2.1 CSc1c[nH]c2c1cncn2 62a_200000210301_100000072862 [0,1,0,0,1,0|2,0,0]=4 1602 B12R2.1 CSc1c[nH]c2c1nccn2 62a_200000210301_100009819587 [0,1,0,0,1,0|2,0,0]=4 1603 B12R2.1 CSc1cnc2n1cccn2 62a_100011934454_200000210301 [0,1,0,0,1,0|2,0,0]=4 1604 B12R2.1 CSc1cnc2n1cccn2 62a_200000210301_100011934454 [0,1,0,0,1,0|2,0,0]=4 1605 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,0,1,0|2,0,0]=4 1606 B12R2.1 CSc1csc2c1cccc2 62a_200000210301_100009813928 [0,1,0,0,1,0|2,0,0]=4 1607 B12R2.1 CSc1csc2c1cccn2 62a_100009830249_200000210301 [0,1,0,0,1,0|1,0,0]=3 1608 B12R2.1 CSc1csc2c1cccn2 62a_200000210301_100009830249 [0,1,0,0,1,0|1,0,0]=3 1609 B12R2.1 CSc1csc2c1nccn2 62a_200000210301_100010174841 [0,1,0,0,1,0|2,0,0]=4 1610 B12R2.1 CSc1n[nH]c2c1cccn2 62a_200000210301_100009888962 [0,1,0,0,1,0|2,0,0]=4 1611 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,0,1,0|2,0,0]=4 1612 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,0,1,0|2,0,0]=4 1613 B12R2.1 [13CH3]Sc1c[nH]c2c1cccn2 62a_200025704644_100011934613 [0,1,0,0,1,0|1,0,0]=3 1614 B12R2.1 [13CH3]Sc1c[nH]c2c1cncn2 62a_100009817560_200025704644 [0,1,0,0,1,0|2,0,0]=4 1615 B12R2.1 [13CH3]Sc1c[nH]c2c1cncn2 62a_200025704644_100000072862 [0,1,0,0,1,0|2,0,0]=4 1616 B12R2.1 [13CH3]Sc1c[nH]c2c1nccn2 62a_200025704644_100009819587 [0,1,0,0,1,0|2,0,0]=4 1617 B12R2.1 [13CH3]Sc1cnc2n1cccn2 62a_100011934454_200025704644 [0,1,0,0,1,0|2,0,0]=4 1618 B12R2.1 [13CH3]Sc1cnc2n1cccn2 62a_200025704644_100011934454 [0,1,0,0,1,0|2,0,0]=4 1619 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,0,1,0|2,0,0]=4 1620 B12R2.1 [13CH3]Sc1csc2c1cccc2 62a_200025704644_100009813928 [0,1,0,0,1,0|2,0,0]=4 1621 B12R2.1 [13CH3]Sc1csc2c1cccn2 62a_100009830249_200025704644 [0,1,0,0,1,0|1,0,0]=3 1622 B12R2.1 [13CH3]Sc1csc2c1cccn2 62a_200025704644_100009830249 [0,1,0,0,1,0|1,0,0]=3 1623 B12R2.1 [13CH3]Sc1csc2c1nccn2 62a_200025704644_100010174841 [0,1,0,0,1,0|2,0,0]=4 1624 B12R2.1 [13CH3]Sc1n[nH]c2c1cccn2 62a_200025704644_100009888962 [0,1,0,0,1,0|2,0,0]=4 1625 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,1,0|2,0,0]=4 1626 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,0,1,0|2,0,0]=4 1627 B12R2.132 Cc1c[nH]c2c1cc(cn2)O 271570a_203496583355_100010202333 [0,1,0,0,1,0|1,0,0]=3 1628 B12R2.132 Cc1cnc2[nH]cc(c2c1)O 271570a_203496583355_100010246215 [0,1,0,0,1,0|2,0,0]=4 1629 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,0,1,0|2,0,0]=4 1630 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,0,1,0|2,0,0]=4 1631 B12R2.132 Cc1n[nH]c2c1cc(cn2)O 271570a_203496583355_100009814706 [0,1,0,0,1,0|2,0,0]=4 1632 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [0,1,0,0,1,0|2,0,0]=4 1633 B12R2.132 Cn1ccc2c1cc(cn2)O 271570a_203496583355_100010761474 [0,1,0,0,1,0|1,0,0]=3 1634 B12R2.132 Cn1ncc2c1cc(cn2)O 271570a_203496583355_100010254267 [0,1,0,0,1,0|2,0,0]=4 1635 B12R2.132 Nc1c[nH]c2c1cc(cn2)O 271570a_203496583355_100010174843 [0,1,0,0,1,0|2,0,0]=4 1636 B12R2.132 Oc1c[nH]c2c1cc(cn2)F 271570a_203496583355_100010168383 [0,1,0,0,1,0|2,0,0]=4 1637 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,0,1,0|2,0,0]=4 1638 B12R2.196 Cn1ccc2c1cccc2O 271570a_203496583355_200011934935 [0,1,0,0,1,0|2,0,0]=4 1639 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [0,1,0,0,1,0|2,0,0]=4 1640 B12R2.203 Cc1c[nH]c2c1c(ccn2)O 271570a_203496583355_100009849662 [0,1,0,0,1,0|1,0,0]=3 1641 B12R2.203 Cc1c[nH]c2c1c(ncn2)O 271570a_203496583355_100000092391 [0,1,0,0,1,0|2,0,0]=4 1642 B12R2.203 Cc1csc2c1c(ncn2)O 271570a_203496583355_100000040732 [0,1,0,0,1,0|2,0,0]=4 1643 B12R2.203 Cn1ccc2c1c(ccc2)O 271570a_203496583355_100009817156 [0,1,0,0,1,0|2,0,0]=4 1644 B12R2.203 Cn1ccc2c1c(ncn2)O 271570a_203496583355_100009847513 [0,1,0,0,1,0|2,0,0]=4 1645 B12R2.203 Nc1c[nH]c2c1c(ccn2)O 271570a_203496583355_100010212589 [0,1,0,0,1,0|2,0,0]=4 1646 B12R2.203 Oc1c[nH]c2c1c(ccn2)Br 271570a_203496583355_100010212587 [0,1,0,0,1,0|2,0,0]=4 1647 B12R2.203 Oc1c[nH]c2c1c(ccn2)F 271570a_203496583355_100010168365 [0,1,0,0,1,0|2,0,0]=4 1648 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,0,1,0|2,0,0]=4 1649 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,0,1,0|2,0,0]=4 1650 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [0,1,0,0,1,0|2,0,0]=4 1651 B12R2.612 Cn1ccc2c1cnc(n2)O 271570a_203496583355_100010385126 [0,1,0,0,1,0|2,0,0]=4 1652 B12R2.612 Cn1ccc2c1ncc(n2)O 271570a_203496583355_100010168881 [0,1,0,0,1,0|2,0,0]=4 1653 B12R2.612 Cn1cnc2c1ccc(n2)O 271570a_203496583355_100010385288 [0,1,0,0,1,0|2,0,0]=4 1654 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,0,1,0|2,0,0]=4 1655 B12R2.2028 Cn1cc(c2c1nccc2)O 271570a_203496583355_100010205794 [0,1,0,0,1,0|2,0,0]=4 1656 B12R2.2028 Cn1nc(c2c1cccn2)O 271570a_203496583355_100000761950 [0,1,0,0,1,0|2,0,0]=4 1657 B12R2.32 C=Cc1cc2cccnc2[nH]1 271570a_100011290941_100010079843 [0,1,0,0,1,0|1,0,1]=4 1658 B12R2.32 CNc1nc2cccnc2s1 27a_100102657272_100010188088 [0,1,0,0,1,0|2,0,0]=4 1659 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,1,0,0,1,0|2,0,0]=4 1660 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,0,1,0|2,0,0]=4 1661 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,1,0,0,1,0|2,0,0]=4 1662 B12R2.32 CSc1cc2cccnc2[nH]1 62a_200000210301_100010079843 [0,1,0,0,1,0|1,0,0]=3 1663 B12R2.32 CSc1cn2ncccc2n1 62a_200000210301_200010296001 [0,1,0,0,1,0|2,0,0]=4 1664 B12R2.32 CSc1cn2ncccc2n1 62a_200010296001_200000210301 [0,1,0,0,1,0|2,0,0]=4 1665 B12R2.32 CSc1nc2cccnc2s1 62a_100010188088_200000210301 [0,1,0,0,1,0|2,0,0]=4 1666 B12R2.32 CSc1nc2cccnc2s1 62a_200000210301_100010188088 [0,1,0,0,1,0|2,0,0]=4 1667 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,1,0,0,1,0|2,0,0]=4 1668 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,0,1,0|2,0,0]=4 1669 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,1,0,0,1,0|2,0,0]=4 1670 B12R2.32 [13CH3]Sc1cc2cccnc2[nH]1 62a_200025704644_100010079843 [0,1,0,0,1,0|1,0,0]=3 1671 B12R2.32 [13CH3]Sc1cn2ncccc2n1 62a_200010296001_200025704644 [0,1,0,0,1,0|2,0,0]=4 1672 B12R2.32 [13CH3]Sc1cn2ncccc2n1 62a_200025704644_200010296001 [0,1,0,0,1,0|2,0,0]=4 1673 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_100010188088_200025704644 [0,1,0,0,1,0|2,0,0]=4 1674 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_200025704644_100010188088 [0,1,0,0,1,0|2,0,0]=4 1675 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,1,0|1,0,1]=4 1676 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,1,0|2,0,0]=4 1677 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,0,1,0|1,0,0]=3 1678 B12R2.202 Cc1cc2c(ncnc2[nH]1)O 271570a_203496583355_100009847220 [0,1,0,0,1,0|2,0,0]=4 1679 B12R2.202 Cc1cc2c(ncnc2s1)O 271570a_203496583355_100000753035 [0,1,0,0,1,0|2,0,0]=4 1680 B12R2.202 Cc1cc2ncnc(c2s1)O 271570a_203496583355_200009846640 [0,1,0,0,1,0|2,0,0]=4 1681 B12R2.202 Oc1cc2c(ccnc2[nH]1)Cl 271570a_203496583355_100010234028 [0,1,0,0,1,0|2,0,0]=4 1682 B12R2.202 Oc1cc2nccc(c2s1)Cl 271570a_203496583355_100010192579 [0,1,0,0,1,0|2,0,0]=4 1683 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,0,1,0|2,0,0]=4 1684 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,0,1,0|2,0,0]=4 1685 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,1,0,0,1,0|1,0,0]=3 1686 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,0,1,0|2,0,0]=4 1687 B12R2.606 Cc1cc2nc(ccn2n1)O 271570a_203496583355_100009892504 [0,1,0,0,1,0|2,0,0]=4 1688 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,1,0,0,1,0|1,0,0]=3 1689 B12R2.606 Cc1cc2ncc(cn2n1)O 271570a_203496583355_100000736869 [0,1,0,0,1,0|2,0,0]=4 1690 B12R2.606 Cc1cn2cc(cnc2n1)O 271570a_203496583355_200012362479 [0,1,0,0,1,0|2,0,0]=4 1691 B12R2.606 Cc1cn2nc(ccc2n1)O 271570a_203496583355_100000086295 [0,1,0,0,1,0|2,0,0]=4 1692 B12R2.606 Cc1nc2cc(cnc2o1)O 271570a_203496583355_100010178690 [0,1,0,0,1,0|2,0,0]=4 1693 B12R2.606 Cc1nc2cc(cnc2s1)O 271570a_203496583355_100010178691 [0,1,0,0,1,0|2,0,0]=4 1694 B12R2.606 Cc1nc2ccc(nc2[nH]1)O 271570a_203496583355_100000079090 [0,1,0,0,1,0|2,0,0]=4 1695 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [0,1,0,0,1,0|2,0,0]=4 1696 B12R2.606 Cc1nc2ncc(cc2o1)O 271570a_203496583355_100010235748 [0,1,0,0,1,0|2,0,0]=4 1697 B12R2.606 Cn1cc2cc(cnc2n1)O 271570a_203496583355_100010114929 [0,1,0,0,1,0|2,0,0]=4 1698 B12R2.44 C=Cc1ccc2[nH]ccc2c1 271570a_100011290941_100000211741 [0,1,0,0,1,0|0,0,2]=4 1699 B12R2.44 C=Cc1ccc2c(c1)C=CC2 271570a_100011290941_100009814306 [0,1,0,0,1,0|0,0,2]=4 1700 B12R2.44 C=Cc1ccc2c(c1)CC=C2 271570a_100011290941_200009818231 [0,1,0,0,1,0|0,0,2]=4 1701 B12R2.44 C=Cc1ccc2cc[nH]c2c1 271570a_100011290941_100000743809 [0,1,0,0,1,0|1,0,1]=4 1702 B12R2.44 C=Cc1ccc2ccoc2c1 271570a_100011290941_100000759542 [0,1,0,0,1,0|1,0,1]=4 1703 B12R2.44 C=Cc1ccc2ccsc2c1 271570a_100011290941_100009888917 [0,1,0,0,1,0|1,0,1]=4 1704 B12R2.44 C=Cc1ccc2cscc2c1 271570a_100011290941_200010760811 [0,1,0,0,1,0|1,0,1]=4 1705 B12R2.44 C=Cc1ccc2nccn2c1 271570a_100011290941_100000746083 [0,1,0,0,1,0|1,0,1]=4 1706 B12R2.44 C=Cc1ccc2ncoc2c1 271570a_100011290941_100009817590 [0,1,0,0,1,0|1,0,1]=4 1707 B12R2.44 C=Cc1ccc2ncsc2c1 271570a_100011290941_100009816678 [0,1,0,0,1,0|1,0,1]=4 1708 B12R2.44 C=Cc1ccc2occc2c1 271570a_100011290941_100012343831 [0,1,0,0,1,0|1,0,1]=4 1709 B12R2.44 C=Cc1ccc2sccc2c1 271570a_100011290941_100009814439 [0,1,0,0,1,0|1,0,1]=4 1710 B12R2.44 C=Cc1ccn2nccc2c1 271570a_100011290941_100000763084 [0,1,0,0,1,0|1,0,1]=4 1711 B12R2.44 CNc1ccc2ccoc2c1 34a_100000102395_200000210301 [0,1,0,0,1,0|1,0,0]=3 1712 B12R2.44 CNc1ccc2cnoc2c1 34a_100000084182_200000210301 [0,1,0,0,1,0|2,0,0]=4 1713 B12R2.44 CNc1ccc2nccn2n1 27a_100102657272_100000058501 [0,1,0,0,1,0|2,0,0]=4 1714 B12R2.44 CNc1ccc2ncoc2c1 34a_100011248239_200000210301 [0,1,0,0,1,0|1,0,0]=3 1715 B12R2.44 CNc1ccc2ncsc2c1 34a_100011215093_200000210301 [0,1,0,0,1,0|1,0,0]=3 1716 B12R2.44 CNc1ccc2ncsc2n1 27a_100102657272_100010381354 [0,1,0,0,1,0|2,0,0]=4 1717 B12R2.44 CNc1ccc2occc2c1 34a_106430523501_200000210301 [0,1,0,0,1,0|1,0,0]=3 1718 B12R2.44 CNc1ccc2ocnc2c1 34a_100011219863_200000210301 [0,1,0,0,1,0|2,0,0]=4 1719 B12R2.44 CNc1ccc2oncc2c1 34a_100000037595_200000210301 [0,1,0,0,1,0|2,0,0]=4 1720 B12R2.44 CNc1ccc2sccc2c1 34a_100000681076_200000210301 [0,1,0,0,1,0|1,0,0]=3 1721 B12R2.44 CNc1ccc2sccc2n1 27a_100102657272_100012000956 [0,1,0,0,1,0|2,0,0]=4 1722 B12R2.44 CNc1ccc2scnc2c1 34a_100000047738_200000210301 [0,1,0,0,1,0|2,0,0]=4 1723 B12R2.44 CNc1ccc2sncc2c1 34a_100000077742_200000210301 [0,1,0,0,1,0|2,0,0]=4 1724 B12R2.44 CNc1ccn2nccc2n1 27a_100102657272_100000051569 [0,1,0,0,1,0|2,0,0]=4 1725 B12R2.44 CNc1ccn2ncnc2c1 27a_100102657272_100009819723 [0,1,0,0,1,0|2,0,0]=4 1726 B12R2.44 COc1ccc2[nH]ccc2c1 34a_100000756620_200000210301 [0,1,0,0,1,0|0,0,1]=3 1727 B12R2.44 COc1ccc2cc[nH]c2c1 34a_100000036713_200000210301 [0,1,0,0,1,0|1,0,0]=3 1728 B12R2.44 COc1ccc2ccoc2c1 34a_100000089557_200000210301 [0,1,0,0,1,0|1,0,0]=3 1729 B12R2.44 COc1ccc2ccoc2c1 7a_100000089557_200000210301 [0,1,0,0,1,0|1,0,0]=3 1730 B12R2.44 COc1ccc2cnoc2c1 34a_100000098417_200000210301 [0,1,0,0,1,0|2,0,0]=4 1731 B12R2.44 COc1ccc2cnoc2c1 7a_100000098417_200000210301 [0,1,0,0,1,0|2,0,0]=4 1732 B12R2.44 COc1ccc2ncsc2c1 34a_100011995850_200000210301 [0,1,0,0,1,0|1,0,0]=3 1733 B12R2.44 COc1ccc2ncsc2c1 7a_100011995850_200000210301 [0,1,0,0,1,0|1,0,0]=3 1734 B12R2.44 COc1ccc2nonc2c1 34a_100000036933_200000210301 [0,1,0,0,1,0|2,0,0]=4 1735 B12R2.44 COc1ccc2occc2c1 34a_100000070125_200000210301 [0,1,0,0,1,0|1,0,0]=3 1736 B12R2.44 COc1ccc2occc2c1 7a_100000070125_200000210301 [0,1,0,0,1,0|1,0,0]=3 1737 B12R2.44 COc1ccc2sccc2c1 34a_100012180905_200000210301 [0,1,0,0,1,0|1,0,0]=3 1738 B12R2.44 COc1ccc2sccc2c1 7a_100012180905_200000210301 [0,1,0,0,1,0|1,0,0]=3 1739 B12R2.44 COc1ccc2scnc2c1 34a_200009850626_200000210301 [0,1,0,0,1,0|2,0,0]=4 1740 B12R2.44 COc1ccc2scnc2c1 7a_200009850626_200000210301 [0,1,0,0,1,0|2,0,0]=4 1741 B12R2.44 COc1ccn2ccnc2c1 34a_100009863278_200000210301 [0,1,0,0,1,0|2,0,0]=4 1742 B12R2.44 COc1cnc2[nH]ccc2c1 34a_100000087691_200000210301 [0,1,0,0,1,0|1,0,1]=4 1743 B12R2.44 CSc1cc2[nH]ccc2cn1 62a_200000210301_100000089685 [0,1,0,0,1,0|2,0,0]=4 1744 B12R2.44 CSc1cc2cc[nH]c2cn1 62a_200000210301_100009864809 [0,1,0,0,1,0|1,0,1]=4 1745 B12R2.44 CSc1cc2sccc2cn1 62a_200000210301_200016184645 [0,1,0,0,1,0|2,0,0]=4 1746 B12R2.44 CSc1ccc2[nH]ccc2c1 62a_200000210301_100000035808 [0,1,0,0,1,0|0,0,1]=3 1747 B12R2.44 CSc1ccc2[nH]ccc2n1 62a_200000210301_100000087148 [0,1,0,0,1,0|1,0,1]=4 1748 B12R2.44 CSc1ccc2[nH]cnc2c1 62a_200000210301_100011265325 [0,1,0,0,1,0|1,0,1]=4 1749 B12R2.44 CSc1ccc2[nH]ncc2c1 62a_200000210301_100000049815 [0,1,0,0,1,0|1,0,1]=4 1750 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_100009814306_200000210301 [0,1,0,0,1,0|0,0,1]=3 1751 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_200000210301_100009814306 [0,1,0,0,1,0|0,0,1]=3 1752 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200000210301_200009818231 [0,1,0,0,1,0|0,0,1]=3 1753 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200009818231_200000210301 [0,1,0,0,1,0|0,0,1]=3 1754 B12R2.44 CSc1ccc2cc[nH]c2c1 62a_200000210301_100000743809 [0,1,0,0,1,0|1,0,0]=3 1755 B12R2.44 CSc1ccc2cc[nH]c2n1 62a_200000210301_100009814870 [0,1,0,0,1,0|2,0,0]=4 1756 B12R2.44 CSc1ccc2ccnn2c1 62a_200000210301_100009820231 [0,1,0,0,1,0|2,0,0]=4 1757 B12R2.44 CSc1ccc2ccoc2c1 62a_200000210301_100000759542 [0,1,0,0,1,0|1,0,0]=3 1758 B12R2.44 CSc1ccc2ccsc2c1 62a_200000210301_100009888917 [0,1,0,0,1,0|1,0,0]=3 1759 B12R2.44 CSc1ccc2cn[nH]c2c1 62a_200000210301_100000049514 [0,1,0,0,1,0|2,0,0]=4 1760 B12R2.44 CSc1ccc2cncn2c1 62a_200000210301_100009887162 [0,1,0,0,1,0|2,0,0]=4 1761 B12R2.44 CSc1ccc2cnoc2c1 62a_200000210301_100009817722 [0,1,0,0,1,0|2,0,0]=4 1762 B12R2.44 CSc1ccc2cscc2c1 62a_200000210301_200010760811 [0,1,0,0,1,0|1,0,0]=3 1763 B12R2.44 CSc1ccc2csnc2c1 62a_200000210301_100010170880 [0,1,0,0,1,0|2,0,0]=4 1764 B12R2.44 CSc1ccc2nc[nH]c2n1 62a_100009820032_200000210301 [0,1,0,0,1,0|2,0,0]=4 1765 B12R2.44 CSc1ccc2nc[nH]c2n1 62a_200000210301_100000077665 [0,1,0,0,1,0|2,0,0]=4 1766 B12R2.44 CSc1ccc2nccn2c1 62a_100000746083_200000210301 [0,1,0,0,1,0|1,0,0]=3 1767 B12R2.44 CSc1ccc2nccn2c1 62a_200000210301_100000746083 [0,1,0,0,1,0|1,0,0]=3 1768 B12R2.44 CSc1ccc2nccn2n1 62a_100009883166_200000210301 [0,1,0,0,1,0|2,0,0]=4 1769 B12R2.44 CSc1ccc2nccn2n1 62a_200000210301_100000058501 [0,1,0,0,1,0|2,0,0]=4 1770 B12R2.44 CSc1ccc2ncnn2c1 62a_100009816971_200000210301 [0,1,0,0,1,0|2,0,0]=4 1771 B12R2.44 CSc1ccc2ncnn2c1 62a_200000210301_100009816971 [0,1,0,0,1,0|2,0,0]=4 1772 B12R2.44 CSc1ccc2ncoc2c1 62a_200000210301_100009817590 [0,1,0,0,1,0|1,0,0]=3 1773 B12R2.44 CSc1ccc2ncsc2c1 62a_100009816678_200000210301 [0,1,0,0,1,0|1,0,0]=3 1774 B12R2.44 CSc1ccc2ncsc2c1 62a_200000210301_100009816678 [0,1,0,0,1,0|1,0,0]=3 1775 B12R2.44 CSc1ccc2ncsc2n1 62a_100010090457_200000210301 [0,1,0,0,1,0|2,0,0]=4 1776 B12R2.44 CSc1ccc2ncsc2n1 62a_200000210301_100010381354 [0,1,0,0,1,0|2,0,0]=4 1777 B12R2.44 CSc1ccc2nn[nH]c2c1 62a_200000210301_100009817464 [0,1,0,0,1,0|2,0,0]=4 1778 B12R2.44 CSc1ccc2nncn2c1 62a_100000764363_200000210301 [0,1,0,0,1,0|2,0,0]=4 1779 B12R2.44 CSc1ccc2nncn2c1 62a_200000210301_100000764363 [0,1,0,0,1,0|2,0,0]=4 1780 B12R2.44 CSc1ccc2nonc2c1 62a_100009814275_200000210301 [0,1,0,0,1,0|2,0,0]=4 1781 B12R2.44 CSc1ccc2nonc2c1 62a_200000210301_100009814275 [0,1,0,0,1,0|2,0,0]=4 1782 B12R2.44 CSc1ccc2nsnc2c1 62a_100009814274_200000210301 [0,1,0,0,1,0|2,0,0]=4 1783 B12R2.44 CSc1ccc2nsnc2c1 62a_200000210301_100009814274 [0,1,0,0,1,0|2,0,0]=4 1784 B12R2.44 CSc1ccc2occc2c1 62a_200000210301_100000691453 [0,1,0,0,1,0|1,0,0]=3 1785 B12R2.44 CSc1ccc2occc2n1 62a_200000210301_100009851292 [0,1,0,0,1,0|2,0,0]=4 1786 B12R2.44 CSc1ccc2ocnc2c1 62a_200000210301_100009816175 [0,1,0,0,1,0|2,0,0]=4 1787 B12R2.44 CSc1ccc2oncc2c1 62a_200000210301_100009817723 [0,1,0,0,1,0|2,0,0]=4 1788 B12R2.44 CSc1ccc2sccc2c1 62a_200000210301_100009814439 [0,1,0,0,1,0|1,0,0]=3 1789 B12R2.44 CSc1ccc2sccc2n1 62a_200000210301_100012000956 [0,1,0,0,1,0|2,0,0]=4 1790 B12R2.44 CSc1ccc2scnc2c1 62a_200000210301_100010005895 [0,1,0,0,1,0|2,0,0]=4 1791 B12R2.44 CSc1ccn2ccnc2c1 62a_200000210301_100000087792 [0,1,0,0,1,0|2,0,0]=4 1792 B12R2.44 CSc1ccn2nccc2c1 62a_200000210301_100000763084 [0,1,0,0,1,0|1,0,0]=3 1793 B12R2.44 CSc1ccn2nccc2n1 62a_100000691470_200000210301 [0,1,0,0,1,0|2,0,0]=4 1794 B12R2.44 CSc1ccn2nccc2n1 62a_200000210301_100000051569 [0,1,0,0,1,0|2,0,0]=4 1795 B12R2.44 CSc1ccn2ncnc2c1 62a_100009819723_200000210301 [0,1,0,0,1,0|2,0,0]=4 1796 B12R2.44 CSc1ccn2ncnc2c1 62a_200000210301_100009819723 [0,1,0,0,1,0|2,0,0]=4 1797 B12R2.44 CSc1ccn2nncc2c1 62a_100009820036_200000210301 [0,1,0,0,1,0|2,0,0]=4 1798 B12R2.44 CSc1ccn2nncc2c1 62a_200000210301_100009820036 [0,1,0,0,1,0|2,0,0]=4 1799 B12R2.44 CSc1cn2ccnc2cn1 62a_102495339940_200000210301 [0,1,0,0,1,0|2,0,0]=4 1800 B12R2.44 CSc1cn2ccnc2cn1 62a_200000210301_102495339940 [0,1,0,0,1,0|2,0,0]=4 1801 B12R2.44 CSc1cnc2[nH]ccc2c1 62a_200000210301_100000760471 [0,1,0,0,1,0|1,0,1]=4 1802 B12R2.44 CSc1cnc2cc[nH]c2c1 62a_200000210301_100009818992 [0,1,0,0,1,0|2,0,0]=4 1803 B12R2.44 CSc1cnc2nc[nH]c2c1 62a_200000210301_100000760087 [0,1,0,0,1,0|2,0,0]=4 1804 B12R2.44 CSc1cnc2nccn2c1 62a_100000764708_200000210301 [0,1,0,0,1,0|2,0,0]=4 1805 B12R2.44 CSc1cnc2nccn2c1 62a_200000210301_100000764708 [0,1,0,0,1,0|2,0,0]=4 1806 B12R2.44 CSc1cnc2ncoc2c1 62a_100000721906_200000210301 [0,1,0,0,1,0|2,0,0]=4 1807 B12R2.44 CSc1cnc2ncoc2c1 62a_200000210301_100000721906 [0,1,0,0,1,0|2,0,0]=4 1808 B12R2.44 CSc1cnc2nscc2c1 62a_200000210301_200020642285 [0,1,0,0,1,0|2,0,0]=4 1809 B12R2.44 CSc1cnc2nscc2c1 62a_200020642285_200000210301 [0,1,0,0,1,0|2,0,0]=4 1810 B12R2.44 CSc1cnc2sccc2c1 62a_200000210301_100010135160 [0,1,0,0,1,0|2,0,0]=4 1811 B12R2.44 [13CH3]Nc1ccc2ccoc2c1 34a_100000102395_200025704644 [0,1,0,0,1,0|1,0,0]=3 1812 B12R2.44 [13CH3]Nc1ccc2cnoc2c1 34a_100000084182_200025704644 [0,1,0,0,1,0|2,0,0]=4 1813 B12R2.44 [13CH3]Nc1ccc2ncoc2c1 34a_100011248239_200025704644 [0,1,0,0,1,0|1,0,0]=3 1814 B12R2.44 [13CH3]Nc1ccc2ncsc2c1 34a_100011215093_200025704644 [0,1,0,0,1,0|1,0,0]=3 1815 B12R2.44 [13CH3]Nc1ccc2occc2c1 34a_106430523501_200025704644 [0,1,0,0,1,0|1,0,0]=3 1816 B12R2.44 [13CH3]Nc1ccc2ocnc2c1 34a_100011219863_200025704644 [0,1,0,0,1,0|2,0,0]=4 1817 B12R2.44 [13CH3]Nc1ccc2oncc2c1 34a_100000037595_200025704644 [0,1,0,0,1,0|2,0,0]=4 1818 B12R2.44 [13CH3]Nc1ccc2sccc2c1 34a_100000681076_200025704644 [0,1,0,0,1,0|1,0,0]=3 1819 B12R2.44 [13CH3]Nc1ccc2scnc2c1 34a_100000047738_200025704644 [0,1,0,0,1,0|2,0,0]=4 1820 B12R2.44 [13CH3]Nc1ccc2sncc2c1 34a_100000077742_200025704644 [0,1,0,0,1,0|2,0,0]=4 1821 B12R2.44 [13CH3]Oc1ccc2[nH]ccc2c1 34a_100000756620_200025704644 [0,1,0,0,1,0|0,0,1]=3 1822 B12R2.44 [13CH3]Oc1ccc2cc[nH]c2c1 34a_100000036713_200025704644 [0,1,0,0,1,0|1,0,0]=3 1823 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 34a_100000089557_200025704644 [0,1,0,0,1,0|1,0,0]=3 1824 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 7a_100000089557_200025704644 [0,1,0,0,1,0|1,0,0]=3 1825 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 34a_100000098417_200025704644 [0,1,0,0,1,0|2,0,0]=4 1826 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 7a_100000098417_200025704644 [0,1,0,0,1,0|2,0,0]=4 1827 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 34a_100011995850_200025704644 [0,1,0,0,1,0|1,0,0]=3 1828 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 7a_100011995850_200025704644 [0,1,0,0,1,0|1,0,0]=3 1829 B12R2.44 [13CH3]Oc1ccc2nonc2c1 34a_100000036933_200025704644 [0,1,0,0,1,0|2,0,0]=4 1830 B12R2.44 [13CH3]Oc1ccc2occc2c1 34a_100000070125_200025704644 [0,1,0,0,1,0|1,0,0]=3 1831 B12R2.44 [13CH3]Oc1ccc2occc2c1 7a_100000070125_200025704644 [0,1,0,0,1,0|1,0,0]=3 1832 B12R2.44 [13CH3]Oc1ccc2sccc2c1 34a_100012180905_200025704644 [0,1,0,0,1,0|1,0,0]=3 1833 B12R2.44 [13CH3]Oc1ccc2sccc2c1 7a_100012180905_200025704644 [0,1,0,0,1,0|1,0,0]=3 1834 B12R2.44 [13CH3]Oc1ccc2scnc2c1 34a_200009850626_200025704644 [0,1,0,0,1,0|2,0,0]=4 1835 B12R2.44 [13CH3]Oc1ccc2scnc2c1 7a_200009850626_200025704644 [0,1,0,0,1,0|2,0,0]=4 1836 B12R2.44 [13CH3]Oc1ccn2ccnc2c1 34a_100009863278_200025704644 [0,1,0,0,1,0|2,0,0]=4 1837 B12R2.44 [13CH3]Oc1cnc2[nH]ccc2c1 34a_100000087691_200025704644 [0,1,0,0,1,0|1,0,1]=4 1838 B12R2.44 [13CH3]Sc1cc2[nH]ccc2cn1 62a_200025704644_100000089685 [0,1,0,0,1,0|2,0,0]=4 1839 B12R2.44 [13CH3]Sc1cc2cc[nH]c2cn1 62a_200025704644_100009864809 [0,1,0,0,1,0|1,0,1]=4 1840 B12R2.44 [13CH3]Sc1cc2sccc2cn1 62a_200025704644_200016184645 [0,1,0,0,1,0|2,0,0]=4 1841 B12R2.44 [13CH3]Sc1ccc2[nH]ccc2c1 62a_200025704644_100000035808 [0,1,0,0,1,0|0,0,1]=3 1842 B12R2.44 [13CH3]Sc1ccc2[nH]ccc2n1 62a_200025704644_100000087148 [0,1,0,0,1,0|1,0,1]=4 1843 B12R2.44 [13CH3]Sc1ccc2[nH]cnc2c1 62a_200025704644_100011265325 [0,1,0,0,1,0|1,0,1]=4 1844 B12R2.44 [13CH3]Sc1ccc2[nH]ncc2c1 62a_200025704644_100000049815 [0,1,0,0,1,0|1,0,1]=4 1845 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_100009814306_200025704644 [0,1,0,0,1,0|0,0,1]=3 1846 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_200025704644_100009814306 [0,1,0,0,1,0|0,0,1]=3 1847 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200009818231_200025704644 [0,1,0,0,1,0|0,0,1]=3 1848 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200025704644_200009818231 [0,1,0,0,1,0|0,0,1]=3 1849 B12R2.44 [13CH3]Sc1ccc2cc[nH]c2c1 62a_200025704644_100000743809 [0,1,0,0,1,0|1,0,0]=3 1850 B12R2.44 [13CH3]Sc1ccc2cc[nH]c2n1 62a_200025704644_100009814870 [0,1,0,0,1,0|2,0,0]=4 1851 B12R2.44 [13CH3]Sc1ccc2ccnn2c1 62a_200025704644_100009820231 [0,1,0,0,1,0|2,0,0]=4 1852 B12R2.44 [13CH3]Sc1ccc2ccoc2c1 62a_200025704644_100000759542 [0,1,0,0,1,0|1,0,0]=3 1853 B12R2.44 [13CH3]Sc1ccc2ccsc2c1 62a_200025704644_100009888917 [0,1,0,0,1,0|1,0,0]=3 1854 B12R2.44 [13CH3]Sc1ccc2cn[nH]c2c1 62a_200025704644_100000049514 [0,1,0,0,1,0|2,0,0]=4 1855 B12R2.44 [13CH3]Sc1ccc2cncn2c1 62a_200025704644_100009887162 [0,1,0,0,1,0|2,0,0]=4 1856 B12R2.44 [13CH3]Sc1ccc2cnoc2c1 62a_200025704644_100009817722 [0,1,0,0,1,0|2,0,0]=4 1857 B12R2.44 [13CH3]Sc1ccc2cscc2c1 62a_200025704644_200010760811 [0,1,0,0,1,0|1,0,0]=3 1858 B12R2.44 [13CH3]Sc1ccc2csnc2c1 62a_200025704644_100010170880 [0,1,0,0,1,0|2,0,0]=4 1859 B12R2.44 [13CH3]Sc1ccc2nc[nH]c2n1 62a_100009820032_200025704644 [0,1,0,0,1,0|2,0,0]=4 1860 B12R2.44 [13CH3]Sc1ccc2nc[nH]c2n1 62a_200025704644_100000077665 [0,1,0,0,1,0|2,0,0]=4 1861 B12R2.44 [13CH3]Sc1ccc2nccn2c1 62a_100000746083_200025704644 [0,1,0,0,1,0|1,0,0]=3 1862 B12R2.44 [13CH3]Sc1ccc2nccn2c1 62a_200025704644_100000746083 [0,1,0,0,1,0|1,0,0]=3 1863 B12R2.44 [13CH3]Sc1ccc2nccn2n1 62a_100009883166_200025704644 [0,1,0,0,1,0|2,0,0]=4 1864 B12R2.44 [13CH3]Sc1ccc2nccn2n1 62a_200025704644_100000058501 [0,1,0,0,1,0|2,0,0]=4 1865 B12R2.44 [13CH3]Sc1ccc2ncnn2c1 62a_100009816971_200025704644 [0,1,0,0,1,0|2,0,0]=4 1866 B12R2.44 [13CH3]Sc1ccc2ncnn2c1 62a_200025704644_100009816971 [0,1,0,0,1,0|2,0,0]=4 1867 B12R2.44 [13CH3]Sc1ccc2ncoc2c1 62a_200025704644_100009817590 [0,1,0,0,1,0|1,0,0]=3 1868 B12R2.44 [13CH3]Sc1ccc2ncsc2c1 62a_100009816678_200025704644 [0,1,0,0,1,0|1,0,0]=3 1869 B12R2.44 [13CH3]Sc1ccc2ncsc2c1 62a_200025704644_100009816678 [0,1,0,0,1,0|1,0,0]=3 1870 B12R2.44 [13CH3]Sc1ccc2ncsc2n1 62a_100010090457_200025704644 [0,1,0,0,1,0|2,0,0]=4 1871 B12R2.44 [13CH3]Sc1ccc2ncsc2n1 62a_200025704644_100010381354 [0,1,0,0,1,0|2,0,0]=4 1872 B12R2.44 [13CH3]Sc1ccc2nn[nH]c2c1 62a_200025704644_100009817464 [0,1,0,0,1,0|2,0,0]=4 1873 B12R2.44 [13CH3]Sc1ccc2nncn2c1 62a_100000764363_200025704644 [0,1,0,0,1,0|2,0,0]=4 1874 B12R2.44 [13CH3]Sc1ccc2nncn2c1 62a_200025704644_100000764363 [0,1,0,0,1,0|2,0,0]=4 1875 B12R2.44 [13CH3]Sc1ccc2nonc2c1 62a_100009814275_200025704644 [0,1,0,0,1,0|2,0,0]=4 1876 B12R2.44 [13CH3]Sc1ccc2nonc2c1 62a_200025704644_100009814275 [0,1,0,0,1,0|2,0,0]=4 1877 B12R2.44 [13CH3]Sc1ccc2nsnc2c1 62a_100009814274_200025704644 [0,1,0,0,1,0|2,0,0]=4 1878 B12R2.44 [13CH3]Sc1ccc2nsnc2c1 62a_200025704644_100009814274 [0,1,0,0,1,0|2,0,0]=4 1879 B12R2.44 [13CH3]Sc1ccc2occc2c1 62a_200025704644_100000691453 [0,1,0,0,1,0|1,0,0]=3 1880 B12R2.44 [13CH3]Sc1ccc2occc2n1 62a_200025704644_100009851292 [0,1,0,0,1,0|2,0,0]=4 1881 B12R2.44 [13CH3]Sc1ccc2ocnc2c1 62a_200025704644_100009816175 [0,1,0,0,1,0|2,0,0]=4 1882 B12R2.44 [13CH3]Sc1ccc2oncc2c1 62a_200025704644_100009817723 [0,1,0,0,1,0|2,0,0]=4 1883 B12R2.44 [13CH3]Sc1ccc2sccc2c1 62a_200025704644_100009814439 [0,1,0,0,1,0|1,0,0]=3 1884 B12R2.44 [13CH3]Sc1ccc2sccc2n1 62a_200025704644_100012000956 [0,1,0,0,1,0|2,0,0]=4 1885 B12R2.44 [13CH3]Sc1ccc2scnc2c1 62a_200025704644_100010005895 [0,1,0,0,1,0|2,0,0]=4 1886 B12R2.44 [13CH3]Sc1ccn2ccnc2c1 62a_200025704644_100000087792 [0,1,0,0,1,0|2,0,0]=4 1887 B12R2.44 [13CH3]Sc1ccn2nccc2c1 62a_200025704644_100000763084 [0,1,0,0,1,0|1,0,0]=3 1888 B12R2.44 [13CH3]Sc1ccn2nccc2n1 62a_100000691470_200025704644 [0,1,0,0,1,0|2,0,0]=4 1889 B12R2.44 [13CH3]Sc1ccn2nccc2n1 62a_200025704644_100000051569 [0,1,0,0,1,0|2,0,0]=4 1890 B12R2.44 [13CH3]Sc1ccn2ncnc2c1 62a_100009819723_200025704644 [0,1,0,0,1,0|2,0,0]=4 1891 B12R2.44 [13CH3]Sc1ccn2ncnc2c1 62a_200025704644_100009819723 [0,1,0,0,1,0|2,0,0]=4 1892 B12R2.44 [13CH3]Sc1ccn2nncc2c1 62a_100009820036_200025704644 [0,1,0,0,1,0|2,0,0]=4 1893 B12R2.44 [13CH3]Sc1ccn2nncc2c1 62a_200025704644_100009820036 [0,1,0,0,1,0|2,0,0]=4 1894 B12R2.44 [13CH3]Sc1cn2ccnc2cn1 62a_102495339940_200025704644 [0,1,0,0,1,0|2,0,0]=4 1895 B12R2.44 [13CH3]Sc1cn2ccnc2cn1 62a_200025704644_102495339940 [0,1,0,0,1,0|2,0,0]=4 1896 B12R2.44 [13CH3]Sc1cnc2[nH]ccc2c1 62a_200025704644_100000760471 [0,1,0,0,1,0|1,0,1]=4 1897 B12R2.44 [13CH3]Sc1cnc2cc[nH]c2c1 62a_200025704644_100009818992 [0,1,0,0,1,0|2,0,0]=4 1898 B12R2.44 [13CH3]Sc1cnc2nc[nH]c2c1 62a_200025704644_100000760087 [0,1,0,0,1,0|2,0,0]=4 1899 B12R2.44 [13CH3]Sc1cnc2nccn2c1 62a_100000764708_200025704644 [0,1,0,0,1,0|2,0,0]=4 1900 B12R2.44 [13CH3]Sc1cnc2nccn2c1 62a_200025704644_100000764708 [0,1,0,0,1,0|2,0,0]=4 1901 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_100000721906_200025704644 [0,1,0,0,1,0|2,0,0]=4 1902 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_200025704644_100000721906 [0,1,0,0,1,0|2,0,0]=4 1903 B12R2.44 [13CH3]Sc1cnc2nscc2c1 62a_200020642285_200025704644 [0,1,0,0,1,0|2,0,0]=4 1904 B12R2.44 [13CH3]Sc1cnc2nscc2c1 62a_200025704644_200020642285 [0,1,0,0,1,0|2,0,0]=4 1905 B12R2.44 [13CH3]Sc1cnc2sccc2c1 62a_200025704644_100010135160 [0,1,0,0,1,0|2,0,0]=4 1906 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,1,0,0,1,0|2,0,0]=4 1907 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [0,1,0,0,1,0|1,0,1]=4 1908 B12R2.82 Cc1c(ccc2n1ccn2)O 271570a_203496583355_100012569086 [0,1,0,0,1,0|2,0,0]=4 1909 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,1,0,0,1,0|0,0,1]=3 1910 B12R2.82 Cc1ccc2[nH]ncc2c1O 271570a_203496583355_100009817104 [0,1,0,0,1,0|1,0,1]=4 1911 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,1,0,0,1,0|1,0,0]=3 1912 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,1,0,0,1,0|2,0,0]=4 1913 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [0,1,0,0,1,0|1,0,0]=3 1914 B12R2.82 Cc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097406 [0,1,0,0,1,0|1,0,1]=4 1915 B12R2.82 Cc1ncc2[nH]ccc2c1O 271570a_203496583355_100011015088 [0,1,0,0,1,0|1,0,1]=4 1916 B12R2.82 Nc1c(ccc2c1scn2)O 271570a_203496583355_100010998030 [0,1,0,0,1,0|2,0,0]=4 1917 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,1,0,0,1,0|2,0,0]=4 1918 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,1,0,0,1,0|1,0,1]=4 1919 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,1,0,0,1,0|2,0,0]=4 1920 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [0,1,0,0,1,0|1,0,1]=4 1921 B12R2.100 Cc1cc2[nH]ccc2cc1O 271570a_203496583355_100010199648 [0,1,0,0,1,0|1,0,0]=3 1922 B12R2.100 Cc1cc2[nH]ncc2cc1O 271570a_203496583355_100009816927 [0,1,0,0,1,0|2,0,0]=4 1923 B12R2.100 Cc1cc2cc[nH]c2cc1O 271570a_203496583355_100010199660 [0,1,0,0,1,0|0,0,1]=3 1924 B12R2.100 Cc1cc2ccsc2cc1O 271570a_203496583355_100010762285 [0,1,0,0,1,0|1,0,0]=3 1925 B12R2.100 Cc1cc2cn[nH]c2cc1O 271570a_203496583355_100009816928 [0,1,0,0,1,0|1,0,1]=4 1926 B12R2.100 Cc1cc2nc[nH]c2cc1O 271570a_203496583355_200010107306 [0,1,0,0,1,0|1,0,1]=4 1927 B12R2.100 Cc1cc2nccn2cc1O 271570a_203496583355_100020606757 [0,1,0,0,1,0|2,0,0]=4 1928 B12R2.100 Cc1cc2ncnn2cc1O 271570a_203496583355_100010254783 [0,1,0,0,1,0|2,0,0]=4 1929 B12R2.100 Cc1nc2[nH]ccc2cc1O 271570a_203496583355_100010212563 [0,1,0,0,1,0|2,0,0]=4 1930 B12R2.100 Cc1nc2[nH]cnc2cc1O 271570a_203496583355_100000689652 [0,1,0,0,1,0|2,0,0]=4 1931 B12R2.100 Nc1cc2[nH]ccc2cc1O 271570a_203496583355_100010212544 [0,1,0,0,1,0|1,0,1]=4 1932 B12R2.100 Nc1cc2[nH]cnc2cc1O 271570a_203496583355_200010336578 [0,1,0,0,1,0|2,0,0]=4 1933 B12R2.100 Oc1cc2[nH]ccc2cc1Br 271570a_203496583355_100000703010 [0,1,0,0,1,0|1,0,1]=4 1934 B12R2.100 Oc1cc2[nH]ccc2cc1F 271570a_203496583355_100009817181 [0,1,0,0,1,0|1,0,1]=4 1935 B12R2.100 Oc1cc2cc[nH]c2cc1F 271570a_203496583355_100000731065 [0,1,0,0,1,0|1,0,1]=4 1936 B12R2.100 Oc1cc2nc[nH]c2cc1F 271570a_203496583355_100012361300 [0,1,0,0,1,0|2,0,0]=4 1937 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [0,1,0,0,1,0|1,0,1]=4 1938 B12R2.246 Cc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100009816732 [0,1,0,0,1,0|1,0,1]=4 1939 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [0,1,0,0,1,0|1,0,0]=3 1940 B12R2.246 Cc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100000095047 [0,1,0,0,1,0|2,0,0]=4 1941 B12R2.246 Cc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100009816876 [0,1,0,0,1,0|2,0,0]=4 1942 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [0,1,0,0,1,0|1,0,0]=3 1943 B12R2.246 Cc1cc(c2ncnn2c1)O 271570a_203496583355_100009817174 [0,1,0,0,1,0|2,0,0]=4 1944 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [0,1,0,0,1,0|1,0,0]=3 1945 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [0,1,0,0,1,0|1,0,1]=4 1946 B12R2.246 Cc1cc(cc2c1nc[nH]2)O 271570a_203496583355_100000239325 [0,1,0,0,1,0|2,0,0]=4 1947 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [0,1,0,0,1,0|2,0,0]=4 1948 B12R2.246 Cc1cc(cn2c1ncc2)O 271570a_203496583355_100000701042 [0,1,0,0,1,0|2,0,0]=4 1949 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [0,1,0,0,1,0|2,0,0]=4 1950 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [0,1,0,0,1,0|1,0,1]=4 1951 B12R2.246 Nc1cc(cc2c1cc[nH]2)O 271570a_203496583355_106744500199 [0,1,0,0,1,0|2,0,0]=4 1952 B12R2.246 Nc1cc(cn2c1ncc2)O 271570a_203496583355_100009816852 [0,1,0,0,1,0|2,0,0]=4 1953 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [0,1,0,0,1,0|1,0,1]=4 1954 B12R2.246 Oc1cc(c2cc[nH]c2c1)Br 271570a_203496583355_100009814775 [0,1,0,0,1,0|2,0,0]=4 1955 B12R2.246 Oc1cc(c2cc[nH]c2c1)F 271570a_203496583355_100010186028 [0,1,0,0,1,0|2,0,0]=4 1956 B12R2.246 Oc1cc(c2nccn2c1)F 271570a_203496583355_100010174814 [0,1,0,0,1,0|2,0,0]=4 1957 B12R2.246 Oc1cc(c2nccn2c1)O 271570a_203496583355_100010074634 [0,1,0,0,1,0|2,0,0]=4 1958 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [0,1,0,0,1,0|2,0,0]=4 1959 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,0,1,0|2,0,0]=4 1960 B12R2.246 Oc1cc(cc2c1[nH]cc2)F 271570a_203496583355_100010138379 [0,1,0,0,1,0|1,0,1]=4 1961 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [0,1,0,0,1,0|2,0,0]=4 1962 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [0,1,0,0,1,0|2,0,0]=4 1963 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [0,1,0,0,1,0|2,0,0]=4 1964 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [0,1,0,0,1,0|2,0,0]=4 1965 B12R2.246 Oc1cc(cc2c1occ2)F 271570a_203496583355_100011935139 [0,1,0,0,1,0|2,0,0]=4 1966 B12R2.246 Oc1cc(cn2c1ncc2)Br 271570a_203496583355_100000687079 [0,1,0,0,1,0|2,0,0]=4 1967 B12R2.246 Oc1cc(cn2c1ncc2)Cl 271570a_203496583355_100010232167 [0,1,0,0,1,0|2,0,0]=4 1968 B12R2.246 Oc1cc(cn2c1ncc2)F 271570a_203496583355_100010289905 [0,1,0,0,1,0|2,0,0]=4 1969 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [0,2,0,0,0,0|1,0,1]=4 1970 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [0,2,0,0,0,0|1,0,1]=4 1971 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [0,2,0,0,0,0|1,0,1]=4 1972 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [0,2,0,0,0,0|1,0,1]=4 1973 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [0,2,0,0,0,0|1,0,1]=4 1974 B14R2.92 C=Cc1ccc2ncccc2c1C 271570a_100011290941_200010137439 [0,2,0,0,0,0|0,0,1]=3 1975 B14R2.92 C=Cc1ccc2ncccc2c1N 271570a_100011290941_200010235790 [0,2,0,0,0,0|0,0,1]=3 1976 B14R2.92 C=Cc1ccc2nccnc2c1C 271570a_100011290941_100135414757 [0,2,0,0,0,0|1,0,1]=4 1977 B14R2.92 CNc1ccc2ccccc2c1Br 34a_100000705303_200000210301 [0,2,0,0,0,0|1,0,0]=3 1978 B14R2.92 CNc1ccc2ccccc2c1Cl 34a_100000075557_200000210301 [0,2,0,0,0,0|1,0,0]=3 1979 B14R2.92 CNc1ccc2ccccc2c1O 34a_100000007060_200000210301 [0,2,0,0,0,0|1,0,0]=3 1980 B14R2.92 CNc1ccc2cnccc2c1Cl 34a_100009851981_200000210301 [0,2,0,0,0,0|2,0,0]=4 1981 B14R2.92 CNc1ccc2ncccc2c1Br 34a_200009995563_200000210301 [0,2,0,0,0,0|0,0,0]=2 1982 B14R2.92 CNc1ccc2nccnc2c1C 27a_100102657272_100135414757 [0,2,0,0,0,0|1,0,0]=3 1983 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [0,2,0,0,0,0|1,0,0]=3 1984 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [0,2,0,0,0,0|1,0,0]=3 1985 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,2,0,0,0,0|1,0,0]=3 1986 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,2,0,0,0,0|1,0,0]=3 1987 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [0,2,0,0,0,0|1,0,0]=3 1988 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [0,2,0,0,0,0|1,0,0]=3 1989 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [0,2,0,0,0,0|1,0,0]=3 1990 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [0,2,0,0,0,0|1,0,0]=3 1991 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [0,2,0,0,0,0|1,0,0]=3 1992 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [0,2,0,0,0,0|1,0,0]=3 1993 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [0,2,0,0,0,0|1,0,0]=3 1994 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [0,2,0,0,0,0|2,0,0]=4 1995 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [0,2,0,0,0,0|2,0,0]=4 1996 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [0,2,0,0,0,0|2,0,0]=4 1997 B14R2.92 COc1ccc2ccncc2c1Br 34a_200010115057_200000210301 [0,2,0,0,0,0|2,0,0]=4 1998 B14R2.92 COc1ccc2ccncc2c1Br 7a_200010115057_200000210301 [0,2,0,0,0,0|2,0,0]=4 1999 B14R2.92 COc1ccc2cnccc2c1Cl 34a_100009824633_200000210301 [0,2,0,0,0,0|2,0,0]=4 2000 B14R2.92 COc1ccc2cnccc2c1Cl 7a_100009824633_200000210301 [0,2,0,0,0,0|2,0,0]=4 2001 B14R2.92 CSc1c[nH]c2ccccc2c1=O 62a_200000210301_100012348052 [0,2,0,0,0,0|2,0,0]=4 2002 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200000210301_200010089984 [0,2,0,0,0,0|1,0,0]=3 2003 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200010089984_200000210301 [0,2,0,0,0,0|1,0,0]=3 2004 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [0,2,0,0,0,0|1,0,0]=3 2005 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [0,2,0,0,0,0|1,0,0]=3 2006 B14R2.92 CSc1ccc2ccccc2c1F 62a_100009832041_200000210301 [0,2,0,0,0,0|1,0,0]=3 2007 B14R2.92 CSc1ccc2ccccc2c1F 62a_200000210301_100009832041 [0,2,0,0,0,0|1,0,0]=3 2008 B14R2.92 CSc1ccc2ccccc2c1N 62a_100009817101_200000210301 [0,2,0,0,0,0|1,0,0]=3 2009 B14R2.92 CSc1ccc2ccccc2c1O 62a_200000210301_100009996032 [0,2,0,0,0,0|1,0,0]=3 2010 B14R2.92 CSc1ccc2cccnc2c1C 62a_200000210301_100010214467 [0,2,0,0,0,0|2,0,0]=4 2011 B14R2.92 CSc1ccc2cccnc2c1F 62a_100010751467_200000210301 [0,2,0,0,0,0|2,0,0]=4 2012 B14R2.92 CSc1ccc2cccnc2c1F 62a_200000210301_100010751467 [0,2,0,0,0,0|2,0,0]=4 2013 B14R2.92 CSc1ccc2cccnc2c1O 62a_200000210301_100009816563 [0,2,0,0,0,0|2,0,0]=4 2014 B14R2.92 CSc1ccc2cnccc2c1N 62a_100010191621_200000210301 [0,2,0,0,0,0|2,0,0]=4 2015 B14R2.92 CSc1ccc2cnccc2c1N 62a_200000210301_100010191621 [0,2,0,0,0,0|2,0,0]=4 2016 B14R2.92 CSc1ccc2ncccc2c1C 62a_200000210301_200010137439 [0,2,0,0,0,0|0,0,0]=2 2017 B14R2.92 CSc1ccc2ncccc2c1C 62a_200010137439_200000210301 [0,2,0,0,0,0|0,0,0]=2 2018 B14R2.92 CSc1ccc2ncccc2c1N 62a_200010235790_200000210301 [0,2,0,0,0,0|0,0,0]=2 2019 B14R2.92 CSc1ccc2nccnc2c1C 62a_100135414757_200000210301 [0,2,0,0,0,0|1,0,0]=3 2020 B14R2.92 CSc1ccc2nccnc2c1C 62a_200000210301_100135414757 [0,2,0,0,0,0|1,0,0]=3 2021 B14R2.92 CSc1cnc2ccccc2c1Cl 62a_200000210301_100012352519 [0,2,0,0,0,0|2,0,0]=4 2022 B14R2.92 CSc1cnc2ccccc2c1N 62a_100009995562_200000210301 [0,2,0,0,0,0|2,0,0]=4 2023 B14R2.92 CSc1cnc2ccccc2c1N 62a_200000210301_100009995562 [0,2,0,0,0,0|2,0,0]=4 2024 B14R2.92 CSc1coc2ccccc2c1=O 62a_200000210301_100009813851 [0,2,0,0,0,0|2,0,0]=4 2025 B14R2.92 CSc1ncc2ccccc2c1N 62a_100009995564_200000210301 [0,2,0,0,0,0|2,0,0]=4 2026 B14R2.92 CSc1ncc2ccccc2c1N 62a_200000210301_100000087573 [0,2,0,0,0,0|2,0,0]=4 2027 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,2,0,0,0,0|1,0,0]=3 2028 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,2,0,0,0,0|1,0,0]=3 2029 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [0,2,0,0,0,0|1,0,0]=3 2030 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [0,2,0,0,0,0|1,0,0]=3 2031 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200010137439_200025704644 [0,2,0,0,0,0|0,0,0]=2 2032 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200025704644_200010137439 [0,2,0,0,0,0|0,0,0]=2 2033 B14R2.92 Cc1c(ccc2c1nccc2)S[13CH3] 62a_200025704644_100010214467 [0,2,0,0,0,0|2,0,0]=4 2034 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_100135414757_200025704644 [0,2,0,0,0,0|1,0,0]=3 2035 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_200025704644_100135414757 [0,2,0,0,0,0|1,0,0]=3 2036 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [0,2,0,0,0,0|1,0,1]=4 2037 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Br 34a_100000705303_200025704644 [0,2,0,0,0,0|1,0,0]=3 2038 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Cl 34a_100000075557_200025704644 [0,2,0,0,0,0|1,0,0]=3 2039 B14R2.92 [13CH3]Nc1ccc2ccccc2c1O 34a_100000007060_200025704644 [0,2,0,0,0,0|1,0,0]=3 2040 B14R2.92 [13CH3]Nc1ccc2cnccc2c1Cl 34a_100009851981_200025704644 [0,2,0,0,0,0|2,0,0]=4 2041 B14R2.92 [13CH3]Nc1ccc2ncccc2c1Br 34a_200009995563_200025704644 [0,2,0,0,0,0|0,0,0]=2 2042 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [0,2,0,0,0,0|1,0,0]=3 2043 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [0,2,0,0,0,0|1,0,0]=3 2044 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [0,2,0,0,0,0|1,0,0]=3 2045 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [0,2,0,0,0,0|1,0,0]=3 2046 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [0,2,0,0,0,0|1,0,0]=3 2047 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [0,2,0,0,0,0|1,0,0]=3 2048 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [0,2,0,0,0,0|1,0,0]=3 2049 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [0,2,0,0,0,0|1,0,0]=3 2050 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [0,2,0,0,0,0|2,0,0]=4 2051 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [0,2,0,0,0,0|2,0,0]=4 2052 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 34a_200010115057_200025704644 [0,2,0,0,0,0|2,0,0]=4 2053 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 7a_200010115057_200025704644 [0,2,0,0,0,0|2,0,0]=4 2054 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 34a_100009824633_200025704644 [0,2,0,0,0,0|2,0,0]=4 2055 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 7a_100009824633_200025704644 [0,2,0,0,0,0|2,0,0]=4 2056 B14R2.92 [13CH3]Sc1c[nH]c2ccccc2c1=O 62a_200025704644_100012348052 [0,2,0,0,0,0|2,0,0]=4 2057 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200010089984_200025704644 [0,2,0,0,0,0|1,0,0]=3 2058 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200025704644_200010089984 [0,2,0,0,0,0|1,0,0]=3 2059 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_100009832041_200025704644 [0,2,0,0,0,0|1,0,0]=3 2060 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_200025704644_100009832041 [0,2,0,0,0,0|1,0,0]=3 2061 B14R2.92 [13CH3]Sc1ccc2ccccc2c1N 62a_100009817101_200025704644 [0,2,0,0,0,0|1,0,0]=3 2062 B14R2.92 [13CH3]Sc1ccc2ccccc2c1O 62a_200025704644_100009996032 [0,2,0,0,0,0|1,0,0]=3 2063 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_100010751467_200025704644 [0,2,0,0,0,0|2,0,0]=4 2064 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_200025704644_100010751467 [0,2,0,0,0,0|2,0,0]=4 2065 B14R2.92 [13CH3]Sc1ccc2cccnc2c1O 62a_200025704644_100009816563 [0,2,0,0,0,0|2,0,0]=4 2066 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_100010191621_200025704644 [0,2,0,0,0,0|2,0,0]=4 2067 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_200025704644_100010191621 [0,2,0,0,0,0|2,0,0]=4 2068 B14R2.92 [13CH3]Sc1ccc2ncccc2c1N 62a_200010235790_200025704644 [0,2,0,0,0,0|0,0,0]=2 2069 B14R2.92 [13CH3]Sc1cnc2ccccc2c1Cl 62a_200025704644_100012352519 [0,2,0,0,0,0|2,0,0]=4 2070 B14R2.92 [13CH3]Sc1cnc2ccccc2c1N 62a_100009995562_200025704644 [0,2,0,0,0,0|2,0,0]=4 2071 B14R2.92 [13CH3]Sc1cnc2ccccc2c1N 62a_200025704644_100009995562 [0,2,0,0,0,0|2,0,0]=4 2072 B14R2.92 [13CH3]Sc1coc2ccccc2c1=O 62a_200025704644_100009813851 [0,2,0,0,0,0|2,0,0]=4 2073 B14R2.92 [13CH3]Sc1ncc2ccccc2c1N 62a_100009995564_200025704644 [0,2,0,0,0,0|2,0,0]=4 2074 B14R2.92 [13CH3]Sc1ncc2ccccc2c1N 62a_200025704644_100000087573 [0,2,0,0,0,0|2,0,0]=4 2075 B14R2.203 C=Cc1c(ccc2c1cccc2)Br 271570a_100011290941_100010090040 [0,2,0,0,0,0|2,0,0]=4 2076 B14R2.203 C=Cc1c(ccc2c1cccc2)C 271570a_100011290941_100000759710 [0,2,0,0,0,0|1,0,0]=3 2077 B14R2.203 C=Cc1c(ccc2c1cccc2)N 271570a_100011290941_100000705303 [0,2,0,0,0,0|2,0,0]=4 2078 B14R2.203 C=Cc1c(ccc2c1cccc2)O 271570a_100011290941_100000183829 [0,2,0,0,0,0|2,0,0]=4 2079 B14R2.203 C=Cc1c(ccc2c1cccn2)N 271570a_100011290941_200009995563 [0,2,0,0,0,0|1,0,0]=3 2080 B14R2.203 C=Cc1c(ccc2c1ccnc2)C 271570a_100011290941_100010204589 [0,2,0,0,0,0|2,0,0]=4 2081 B14R2.203 C=Cc1c(ccc2c1nccn2)N 271570a_100011290941_100000729981 [0,2,0,0,0,0|2,0,0]=4 2082 B14R2.203 C=Cc1c(cnc2c1cccc2)C 271570a_100011290941_100000092342 [0,2,0,0,0,0|2,0,0]=4 2083 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [0,2,0,0,0,0|2,0,0]=4 2084 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [0,2,0,0,0,0|1,0,0]=3 2085 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [0,2,0,0,0,0|2,0,0]=4 2086 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [0,2,0,0,0,0|2,0,0]=4 2087 B14R2.203 CNc1c(ccc2c1cccn2)C 34a_100011933972_200000210301 [0,2,0,0,0,0|0,0,0]=2 2088 B14R2.203 CNc1c(ccc2c1nccc2)C 34a_100000065890_200000210301 [0,2,0,0,0,0|2,0,0]=4 2089 B14R2.203 CNc1c(ccc2c1nccn2)N 27a_100102657272_100000729981 [0,2,0,0,0,0|2,0,0]=4 2090 B14R2.203 CNc1c(cnc2c1cccc2)C 27a_100102657272_100000092342 [0,2,0,0,0,0|2,0,0]=4 2091 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 2092 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 2093 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [0,2,0,0,0,0|1,0,0]=3 2094 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [0,2,0,0,0,0|1,0,0]=3 2095 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [0,2,0,0,0,0|2,0,0]=4 2096 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [0,2,0,0,0,0|2,0,0]=4 2097 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [0,2,0,0,0,0|2,0,0]=4 2098 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [0,2,0,0,0,0|2,0,0]=4 2099 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [0,2,0,0,0,0|1,0,0]=3 2100 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [0,2,0,0,0,0|1,0,0]=3 2101 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [0,2,0,0,0,0|2,0,0]=4 2102 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [0,2,0,0,0,0|2,0,0]=4 2103 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [0,2,0,0,0,0|2,0,0]=4 2104 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200000210301_200009995563 [0,2,0,0,0,0|1,0,0]=3 2105 B14R2.203 CSc1c(ccc2c1cccn2)N 62a_200009995563_200000210301 [0,2,0,0,0,0|1,0,0]=3 2106 B14R2.203 CSc1c(ccc2c1ccnc2)C 62a_100010204589_200000210301 [0,2,0,0,0,0|2,0,0]=4 2107 B14R2.203 CSc1c(ccc2c1ccnc2)C 62a_200000210301_100010204589 [0,2,0,0,0,0|2,0,0]=4 2108 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_100000729981_200000210301 [0,2,0,0,0,0|2,0,0]=4 2109 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_200000210301_100000729981 [0,2,0,0,0,0|2,0,0]=4 2110 B14R2.203 CSc1c(cnc2c1cccc2)C 62a_200000210301_100000092342 [0,2,0,0,0,0|2,0,0]=4 2111 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [0,2,0,0,0,0|1,0,0]=3 2112 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [0,2,0,0,0,0|1,0,0]=3 2113 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [0,2,0,0,0,0|1,0,0]=3 2114 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [0,2,0,0,0,0|1,0,0]=3 2115 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [0,2,0,0,0,0|1,0,0]=3 2116 B14R2.203 Cc1ccc2cccnc2c1N[13CH3] 34a_100000065890_200025704644 [0,2,0,0,0,0|2,0,0]=4 2117 B14R2.203 Cc1ccc2cnccc2c1S[13CH3] 62a_100010204589_200025704644 [0,2,0,0,0,0|2,0,0]=4 2118 B14R2.203 Cc1ccc2cnccc2c1S[13CH3] 62a_200025704644_100010204589 [0,2,0,0,0,0|2,0,0]=4 2119 B14R2.203 Cc1ccc2ncccc2c1N[13CH3] 34a_100011933972_200025704644 [0,2,0,0,0,0|0,0,0]=2 2120 B14R2.203 Cc1cnc2ccccc2c1S[13CH3] 62a_200025704644_100000092342 [0,2,0,0,0,0|2,0,0]=4 2121 B14R2.203 O=Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010090029 [0,2,0,0,0,0|2,0,0]=4 2122 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [0,2,0,0,0,0|2,0,0]=4 2123 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [0,2,0,0,0,0|2,0,0]=4 2124 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [0,2,0,0,0,0|2,0,0]=4 2125 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 2126 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 2127 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [0,2,0,0,0,0|2,0,0]=4 2128 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [0,2,0,0,0,0|2,0,0]=4 2129 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [0,2,0,0,0,0|2,0,0]=4 2130 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [0,2,0,0,0,0|2,0,0]=4 2131 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [0,2,0,0,0,0|2,0,0]=4 2132 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [0,2,0,0,0,0|2,0,0]=4 2133 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200009995563_200025704644 [0,2,0,0,0,0|1,0,0]=3 2134 B14R2.203 [13CH3]Sc1c(ccc2c1cccn2)N 62a_200025704644_200009995563 [0,2,0,0,0,0|1,0,0]=3 2135 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_100000729981_200025704644 [0,2,0,0,0,0|2,0,0]=4 2136 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_200025704644_100000729981 [0,2,0,0,0,0|2,0,0]=4 2137 B14R2.4513 Cc1ccc2occ(c(=O)c2c1)O 271570a_203496583355_200010005421 [0,2,0,0,0,0|1,0,0]=3 2138 B14R2.4513 Cn1c(=O)cnc2c1cc(cc2)O 271570a_203496583355_100010221214 [0,2,0,0,0,0|2,0,0]=4 2139 B14R2.4513 Cn1ccc2ccc(cc2c1=O)O 271570a_203496583355_100010371002 [0,2,0,0,0,0|2,0,0]=4 2140 B14R2.4513 Cn1cnc2ccc(cc2c1=O)O 271570a_203496583355_100009814510 [0,2,0,0,0,0|2,0,0]=4 2141 B14R2.4513 O=c1c(c[nH]c2c1cc(cc2)Br)O 271570a_203496583355_100012348040 [0,2,0,0,0,0|1,0,1]=4 2142 B14R2.4513 O=c1c(coc2c1cc(cc2)Cl)O 271570a_203496583355_200010204847 [0,2,0,0,0,0|2,0,0]=4 2143 B14R2.4513 O=c1c(coc2c1cc(cc2)F)O 271570a_203496583355_200009813772 [0,2,0,0,0,0|2,0,0]=4 2144 B14R2.7724 Cn1cc(c2ccccc2c1=O)O 271570a_203496583355_100000239302 [0,2,0,0,0,0|2,0,0]=4 2145 B14R2.7724 Oc1cc(c2ncccc2c1F)F 271570a_203496583355_200009817093 [0,2,0,0,0,0|1,0,0]=3 2146 B14R2.8038 Cc1ccc2c(ccnc2c1C)O 271570a_203496583355_100011310510 [0,2,0,0,0,0|2,0,0]=4 2147 B14R2.8038 Cc1ccc2c(nccc2c1O)N 271570a_203496583355_100010201667 [0,2,0,0,0,0|2,0,0]=4 2148 B14R2.8188 Oc1c(cc2ncccc2c1F)F 271570a_203496583355_100010163946 [0,2,0,0,0,0|1,0,0]=3 2149 B14R2.28523 Cc1c(ccc2c1c(=O)[nH]cn2)O 271570a_203496583355_206256548267 [0,2,0,0,0,0|2,0,0]=4 2150 B14R2.28523 Cn1ccc2cccc(c2c1=O)O 271570a_203496583355_100010332868 [0,2,0,0,0,0|2,0,0]=4 2151 B14R2.29369 Cc1ccc2c(c(ccc2n1)F)O 271570a_203496583355_100010730238 [0,2,0,0,0,0|1,0,0]=3 2152 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [0,2,0,0,0,0|1,0,0]=3 2153 B14R2.29369 Cn1ccc2cc(ccc2c1=O)O 271570a_203496583355_100010246303 [0,2,0,0,0,0|2,0,0]=4 2154 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [0,2,0,0,0,0|2,0,0]=4 2155 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [0,2,0,0,0,0|2,0,0]=4 2156 B14R2.112 C=C=Cc1ccc2ccccc2c1 271570a_100015277604_100000233703 [0,2,0,0,0,0|1,0,1]=4 2157 B14R2.112 C=C=Cc1ccc2ncccc2c1 271570a_100015277604_100000754243 [0,2,0,0,0,0|0,0,1]=3 2158 B14R2.112 C=C=Cc1ccc2ncccc2n1 271570a_100015277604_100000073381 [0,2,0,0,0,0|1,0,1]=4 2159 B14R2.112 C=C=Cc1ccc2nccnc2c1 271570a_100015277604_100011219451 [0,2,0,0,0,0|1,0,1]=4 2160 B14R2.112 C=C=Cc1ccc2ncncc2c1 271570a_100015277604_100009989443 [0,2,0,0,0,0|1,0,1]=4 2161 B14R2.112 C=C=Cc1ccc2nnccc2c1 271570a_100015277604_100010209549 [0,2,0,0,0,0|1,0,1]=4 2162 B14R2.112 CC=Cc1cc2ccccc2cn1 271570a_100016259895_100000047361 [0,2,0,0,0,0|2,0,0]=4 2163 B14R2.112 CC=Cc1cc2nccnc2cn1 271570a_100016259895_100010370699 [0,2,0,0,0,0|2,0,0]=4 2164 B14R2.112 CC=Cc1ccc2ccccc2c1 271570a_100016259895_100000233703 [0,2,0,0,0,0|1,0,0]=3 2165 B14R2.112 CC=Cc1ccc2ccccc2n1 271570a_100016259895_100011291633 [0,2,0,0,0,0|2,0,0]=4 2166 B14R2.112 CC=Cc1ccc2cccnc2c1 271570a_100016259895_100009816655 [0,2,0,0,0,0|2,0,0]=4 2167 B14R2.112 CC=Cc1ccc2ccncc2c1 271570a_100016259895_100000686496 [0,2,0,0,0,0|2,0,0]=4 2168 B14R2.112 CC=Cc1ccc2cnccc2c1 271570a_100016259895_100009816743 [0,2,0,0,0,0|2,0,0]=4 2169 B14R2.112 CC=Cc1ccc2ncccc2c1 271570a_100016259895_100000754243 [0,2,0,0,0,0|0,0,0]=2 2170 B14R2.112 CC=Cc1ccc2ncccc2n1 271570a_100016259895_100000073381 [0,2,0,0,0,0|1,0,0]=3 2171 B14R2.112 CC=Cc1ccc2nccnc2c1 271570a_100016259895_100011219451 [0,2,0,0,0,0|1,0,0]=3 2172 B14R2.112 CC=Cc1ccc2nccnc2n1 271570a_100016259895_100012351543 [0,2,0,0,0,0|2,0,0]=4 2173 B14R2.112 CC=Cc1ccc2ncncc2c1 271570a_100016259895_100009989443 [0,2,0,0,0,0|1,0,0]=3 2174 B14R2.112 CC=Cc1ccc2nnccc2c1 271570a_100016259895_100010209549 [0,2,0,0,0,0|1,0,0]=3 2175 B14R2.112 CC=Cc1cnc2ccccc2c1 271570a_100016259895_100000737414 [0,2,0,0,0,0|2,0,0]=4 2176 B14R2.112 CC=Cc1cnc2ncccc2n1 271570a_100016259895_100000084304 [0,2,0,0,0,0|2,0,0]=4 2177 B14R2.112 CC=Cc1cnc2nccnc2c1 271570a_100016259895_100000753224 [0,2,0,0,0,0|2,0,0]=4 2178 B14R2.112 CCNc1cc2nccnc2cn1 27a_100015525214_100000070204 [0,2,0,0,0,0|2,0,0]=4 2179 B14R2.112 CCNc1ccc2ccccc2c1 34a_100000211940_100000210202 [0,2,0,0,0,0|1,0,0]=3 2180 B14R2.112 CCNc1ccc2ccccc2c1 7a_100000211940_100000210202 [0,2,0,0,0,0|1,0,0]=3 2181 B14R2.112 CCNc1ccc2ccccc2n1 27a_100015525214_100011291633 [0,2,0,0,0,0|2,0,0]=4 2182 B14R2.112 CCNc1ccc2cccnc2c1 34a_100102887122_100000210202 [0,2,0,0,0,0|2,0,0]=4 2183 B14R2.112 CCNc1ccc2cnccc2c1 34a_100000039641_100000210202 [0,2,0,0,0,0|2,0,0]=4 2184 B14R2.112 CCNc1ccc2ncccc2c1 34a_100011198106_100000210202 [0,2,0,0,0,0|0,0,0]=2 2185 B14R2.112 CCNc1ccc2ncccc2n1 27a_100015525214_100000073381 [0,2,0,0,0,0|1,0,0]=3 2186 B14R2.112 CCNc1ccc2nccnc2c1 27a_100015525214_100011219451 [0,2,0,0,0,0|1,0,0]=3 2187 B14R2.112 CCNc1ccc2nccnc2c1 34a_100011219565_100000210202 [0,2,0,0,0,0|1,0,0]=3 2188 B14R2.112 CCNc1ccc2nccnc2n1 27a_100015525214_100012351543 [0,2,0,0,0,0|2,0,0]=4 2189 B14R2.112 CCNc1cnc2ncccc2n1 27a_100015525214_100000084304 [0,2,0,0,0,0|2,0,0]=4 2190 B14R2.112 CCNc1cnc2nccnc2c1 27a_100015525214_100000753224 [0,2,0,0,0,0|2,0,0]=4 2191 B14R2.112 CCOc1ccc2ccccc2c1 34a_100000185828_100000210202 [0,2,0,0,0,0|1,0,0]=3 2192 B14R2.112 CCOc1ccc2ccccc2c1 7a_100000185828_100000210202 [0,2,0,0,0,0|1,0,0]=3 2193 B14R2.112 CCOc1ccc2cccnc2c1 34a_100011216045_100000210202 [0,2,0,0,0,0|2,0,0]=4 2194 B14R2.112 CCOc1ccc2ccncc2c1 7a_100000752006_100000210202 [0,2,0,0,0,0|2,0,0]=4 2195 B14R2.112 CCOc1ccc2cnccc2c1 34a_100000046372_100000210202 [0,2,0,0,0,0|2,0,0]=4 2196 B14R2.112 CCOc1ccc2cnccc2c1 7a_100000046372_100000210202 [0,2,0,0,0,0|2,0,0]=4 2197 B14R2.112 CCOc1ccc2ncccc2c1 34a_100011215586_100000210202 [0,2,0,0,0,0|0,0,0]=2 2198 B14R2.112 CCOc1ccc2ncccc2c1 7a_100011215586_100000210202 [0,2,0,0,0,0|0,0,0]=2 2199 B14R2.112 CCOc1ccc2nccnc2c1 34a_100000694412_100000210202 [0,2,0,0,0,0|1,0,0]=3 2200 B14R2.112 CCOc1cnc2ccccc2c1 34a_100011934006_100000210202 [0,2,0,0,0,0|2,0,0]=4 2201 B14R2.112 CCOc1cnc2ccccc2c1 7a_100011934006_100000210202 [0,2,0,0,0,0|2,0,0]=4 2202 B14R2.112 CCSc1cc2ccccc2cn1 62a_100000210202_100000047361 [0,2,0,0,0,0|2,0,0]=4 2203 B14R2.112 CCSc1cc2ccccc2cn1 62a_100009816522_100000210202 [0,2,0,0,0,0|2,0,0]=4 2204 B14R2.112 CCSc1cc2nccnc2cn1 62a_100000210202_100010370699 [0,2,0,0,0,0|2,0,0]=4 2205 B14R2.112 CCSc1cc2nccnc2cn1 62a_100010370699_100000210202 [0,2,0,0,0,0|2,0,0]=4 2206 B14R2.112 CCSc1ccc2ccccc2c1 62a_100000210202_100000233703 [0,2,0,0,0,0|1,0,0]=3 2207 B14R2.112 CCSc1ccc2ccccc2n1 62a_100000210202_100011291633 [0,2,0,0,0,0|2,0,0]=4 2208 B14R2.112 CCSc1ccc2ccccc2n1 62a_100011291633_100000210202 [0,2,0,0,0,0|2,0,0]=4 2209 B14R2.112 CCSc1ccc2cccnc2c1 62a_100000210202_100009816655 [0,2,0,0,0,0|2,0,0]=4 2210 B14R2.112 CCSc1ccc2ccncc2c1 62a_100000210202_100000686496 [0,2,0,0,0,0|2,0,0]=4 2211 B14R2.112 CCSc1ccc2ccncc2c1 62a_100000686496_100000210202 [0,2,0,0,0,0|2,0,0]=4 2212 B14R2.112 CCSc1ccc2cnccc2c1 62a_100000210202_100009816743 [0,2,0,0,0,0|2,0,0]=4 2213 B14R2.112 CCSc1ccc2cnccc2c1 62a_100009816743_100000210202 [0,2,0,0,0,0|2,0,0]=4 2214 B14R2.112 CCSc1ccc2ncccc2c1 62a_100000210202_100011215947 [0,2,0,0,0,0|0,0,0]=2 2215 B14R2.112 CCSc1ccc2ncccc2c1 62a_100011215947_100000210202 [0,2,0,0,0,0|0,0,0]=2 2216 B14R2.112 CCSc1ccc2ncccc2n1 62a_100000210202_100000073381 [0,2,0,0,0,0|1,0,0]=3 2217 B14R2.112 CCSc1ccc2nccnc2c1 62a_100000210202_100011219451 [0,2,0,0,0,0|1,0,0]=3 2218 B14R2.112 CCSc1ccc2nccnc2c1 62a_100011219451_100000210202 [0,2,0,0,0,0|1,0,0]=3 2219 B14R2.112 CCSc1ccc2nccnc2n1 62a_100000210202_100012351543 [0,2,0,0,0,0|2,0,0]=4 2220 B14R2.112 CCSc1ccc2nccnc2n1 62a_100012351543_100000210202 [0,2,0,0,0,0|2,0,0]=4 2221 B14R2.112 CCSc1ccc2ncncc2c1 62a_100000210202_100009989443 [0,2,0,0,0,0|1,0,0]=3 2222 B14R2.112 CCSc1ccc2ncncc2c1 62a_100009989443_100000210202 [0,2,0,0,0,0|1,0,0]=3 2223 B14R2.112 CCSc1ccc2nnccc2c1 62a_100000210202_100010209549 [0,2,0,0,0,0|1,0,0]=3 2224 B14R2.112 CCSc1ccc2nnccc2c1 62a_100010209549_100000210202 [0,2,0,0,0,0|1,0,0]=3 2225 B14R2.112 CCSc1cnc2ccccc2c1 62a_100000210202_100000737414 [0,2,0,0,0,0|2,0,0]=4 2226 B14R2.112 CCSc1cnc2ncccc2n1 62a_100000084304_100000210202 [0,2,0,0,0,0|2,0,0]=4 2227 B14R2.112 CCSc1cnc2ncccc2n1 62a_100000210202_100000084304 [0,2,0,0,0,0|2,0,0]=4 2228 B14R2.112 CCSc1cnc2nccnc2c1 62a_100000210202_100000753224 [0,2,0,0,0,0|2,0,0]=4 2229 B14R2.112 CCSc1cnc2nccnc2c1 62a_100000753224_100000210202 [0,2,0,0,0,0|2,0,0]=4 2230 B14R2.112 CNCc1cc2ccccc2cn1 207a_100102657272_100000059776 [0,2,0,0,0,0|2,0,0]=4 2231 B14R2.112 CNCc1cc2ccccc2cn1 2230a_106832991635_100009869231 [0,2,0,0,0,0|2,0,0]=4 2232 B14R2.112 CNCc1cc2ccccc2cn1 270004a_106832991635_100000059776 [0,2,0,0,0,0|2,0,0]=4 2233 B14R2.112 CNCc1cc2ccccc2cn1 34a_100102657272_100009869231 [0,2,0,0,0,0|2,0,0]=4 2234 B14R2.112 CNCc1cc2ccccc2cn1 7a_106832991635_100009869231 [0,2,0,0,0,0|2,0,0]=4 2235 B14R2.112 CNCc1ccc2ccccc2c1 207a_100102657272_100000211584 [0,2,0,0,0,0|1,0,0]=3 2236 B14R2.112 CNCc1ccc2ccccc2c1 2230a_100000739491_200000210301 [0,2,0,0,0,0|1,0,0]=3 2237 B14R2.112 CNCc1ccc2ccccc2c1 2230a_106832991635_100011216711 [0,2,0,0,0,0|1,0,0]=3 2238 B14R2.112 CNCc1ccc2ccccc2c1 270004a_106832991635_100000211584 [0,2,0,0,0,0|1,0,0]=3 2239 B14R2.112 CNCc1ccc2ccccc2c1 34a_100000739491_200000210301 [0,2,0,0,0,0|1,0,0]=3 2240 B14R2.112 CNCc1ccc2ccccc2c1 34a_100102657272_100011216711 [0,2,0,0,0,0|1,0,0]=3 2241 B14R2.112 CNCc1ccc2ccccc2c1 7a_106832991635_100011216711 [0,2,0,0,0,0|1,0,0]=3 2242 B14R2.112 CNCc1ccc2ccccc2n1 207a_100102657272_100000759686 [0,2,0,0,0,0|2,0,0]=4 2243 B14R2.112 CNCc1ccc2ccccc2n1 2230a_106832991635_100000737579 [0,2,0,0,0,0|2,0,0]=4 2244 B14R2.112 CNCc1ccc2ccccc2n1 270004a_106832991635_100000759686 [0,2,0,0,0,0|2,0,0]=4 2245 B14R2.112 CNCc1ccc2ccccc2n1 34a_100102657272_100000737579 [0,2,0,0,0,0|2,0,0]=4 2246 B14R2.112 CNCc1ccc2ccccc2n1 7a_106832991635_100000737579 [0,2,0,0,0,0|2,0,0]=4 2247 B14R2.112 CNCc1ccc2cccnc2c1 207a_100102657272_100011784159 [0,2,0,0,0,0|2,0,0]=4 2248 B14R2.112 CNCc1ccc2cccnc2c1 270004a_106832991635_100011784159 [0,2,0,0,0,0|2,0,0]=4 2249 B14R2.112 CNCc1ccc2cnccc2c1 207a_100102657272_100000068276 [0,2,0,0,0,0|2,0,0]=4 2250 B14R2.112 CNCc1ccc2cnccc2c1 2230a_106832991635_100020605334 [0,2,0,0,0,0|2,0,0]=4 2251 B14R2.112 CNCc1ccc2cnccc2c1 270004a_106832991635_100000068276 [0,2,0,0,0,0|2,0,0]=4 2252 B14R2.112 CNCc1ccc2cnccc2c1 34a_100102657272_100020605334 [0,2,0,0,0,0|2,0,0]=4 2253 B14R2.112 CNCc1ccc2cnccc2c1 7a_106832991635_100020605334 [0,2,0,0,0,0|2,0,0]=4 2254 B14R2.112 CNCc1ccc2ncccc2c1 207a_100102657272_100000211315 [0,2,0,0,0,0|0,0,0]=2 2255 B14R2.112 CNCc1ccc2ncccc2c1 2230a_106832991635_100000703657 [0,2,0,0,0,0|0,0,0]=2 2256 B14R2.112 CNCc1ccc2ncccc2c1 270004a_106832991635_100000211315 [0,2,0,0,0,0|0,0,0]=2 2257 B14R2.112 CNCc1ccc2ncccc2c1 34a_100000238500_200000210301 [0,2,0,0,0,0|0,0,0]=2 2258 B14R2.112 CNCc1ccc2ncccc2c1 34a_100102657272_100000703657 [0,2,0,0,0,0|0,0,0]=2 2259 B14R2.112 CNCc1ccc2ncccc2c1 7a_106832991635_100000703657 [0,2,0,0,0,0|0,0,0]=2 2260 B14R2.112 CNCc1ccc2nccnc2c1 2230a_106832991635_200011762199 [0,2,0,0,0,0|1,0,0]=3 2261 B14R2.112 CNCc1ccc2nccnc2c1 270004a_106832991635_100000239887 [0,2,0,0,0,0|1,0,0]=3 2262 B14R2.112 CNCc1ccc2nccnc2c1 7a_106832991635_200011762199 [0,2,0,0,0,0|1,0,0]=3 2263 B14R2.112 CNCc1cnc2ccccc2c1 207a_100102657272_100000750898 [0,2,0,0,0,0|2,0,0]=4 2264 B14R2.112 CNCc1cnc2ccccc2c1 270004a_106832991635_100000750898 [0,2,0,0,0,0|2,0,0]=4 2265 B14R2.112 CNCc1cnc2ccccc2c1 34a_100000742225_200000210301 [0,2,0,0,0,0|2,0,0]=4 2266 B14R2.112 COCc1cc2ccccc2cn1 34a_100138415774_100009869231 [0,2,0,0,0,0|2,0,0]=4 2267 B14R2.112 COCc1ccc2ccccc2c1 34a_100011215330_200000210301 [0,2,0,0,0,0|1,0,0]=3 2268 B14R2.112 COCc1ccc2ccccc2c1 34a_100138415774_100011216711 [0,2,0,0,0,0|1,0,0]=3 2269 B14R2.112 COCc1ccc2ccccc2c1 7a_100011215330_200000210301 [0,2,0,0,0,0|1,0,0]=3 2270 B14R2.112 COCc1ccc2ccccc2n1 34a_100138415774_100000737579 [0,2,0,0,0,0|2,0,0]=4 2271 B14R2.112 COCc1ccc2cnccc2c1 34a_100138415774_100020605334 [0,2,0,0,0,0|2,0,0]=4 2272 B14R2.112 COCc1ccc2ncccc2c1 34a_100011315636_200000210301 [0,2,0,0,0,0|0,0,0]=2 2273 B14R2.112 COCc1ccc2ncccc2c1 34a_100138415774_100000703657 [0,2,0,0,0,0|0,0,0]=2 2274 B14R2.112 COCc1cnc2ccccc2c1 34a_100011258773_200000210301 [0,2,0,0,0,0|2,0,0]=4 2275 B14R2.112 CSCc1cc2ccccc2cn1 62a_100009869231_200000210301 [0,2,0,0,0,0|2,0,0]=4 2276 B14R2.112 CSCc1cc2ccccc2cn1 62a_200000210301_100009869231 [0,2,0,0,0,0|2,0,0]=4 2277 B14R2.112 CSCc1ccc2ccccc2c1 62a_100011216711_200000210301 [0,2,0,0,0,0|1,0,0]=3 2278 B14R2.112 CSCc1ccc2ccccc2c1 62a_200000210301_100011216711 [0,2,0,0,0,0|1,0,0]=3 2279 B14R2.112 CSCc1ccc2ccccc2n1 62a_100000737579_200000210301 [0,2,0,0,0,0|2,0,0]=4 2280 B14R2.112 CSCc1ccc2ccccc2n1 62a_200000210301_100000737579 [0,2,0,0,0,0|2,0,0]=4 2281 B14R2.112 CSCc1ccc2cnccc2c1 62a_100020605334_200000210301 [0,2,0,0,0,0|2,0,0]=4 2282 B14R2.112 CSCc1ccc2cnccc2c1 62a_200000210301_100020605334 [0,2,0,0,0,0|2,0,0]=4 2283 B14R2.112 CSCc1ccc2ncccc2c1 62a_100000703657_200000210301 [0,2,0,0,0,0|0,0,0]=2 2284 B14R2.112 CSCc1ccc2ncccc2c1 62a_200000210301_100000703657 [0,2,0,0,0,0|0,0,0]=2 2285 B14R2.112 CSCc1ccc2nccnc2c1 62a_200000210301_200011762199 [0,2,0,0,0,0|1,0,0]=3 2286 B14R2.112 CSCc1ccc2nccnc2c1 62a_200011762199_200000210301 [0,2,0,0,0,0|1,0,0]=3 2287 B14R2.112 FCNc1ccc2ccccc2c1 34a_100000211940_100015361967 [0,2,0,0,0,0|1,0,0]=3 2288 B14R2.112 FCNc1ccc2ccccc2c1 7a_100000211940_100015361967 [0,2,0,0,0,0|1,0,0]=3 2289 B14R2.112 FCNc1ccc2cccnc2c1 34a_100102887122_100015361967 [0,2,0,0,0,0|2,0,0]=4 2290 B14R2.112 FCNc1ccc2cnccc2c1 34a_100000039641_100015361967 [0,2,0,0,0,0|2,0,0]=4 2291 B14R2.112 FCNc1ccc2ncccc2c1 34a_100011198106_100015361967 [0,2,0,0,0,0|0,0,0]=2 2292 B14R2.112 FCNc1ccc2nccnc2c1 34a_100011219565_100015361967 [0,2,0,0,0,0|1,0,0]=3 2293 B14R2.112 FCOc1ccc2ccccc2c1 34a_100000185828_100015361967 [0,2,0,0,0,0|1,0,0]=3 2294 B14R2.112 FCOc1ccc2ccccc2c1 7a_100000185828_100015361967 [0,2,0,0,0,0|1,0,0]=3 2295 B14R2.112 FCOc1ccc2cccnc2c1 34a_100011216045_100015361967 [0,2,0,0,0,0|2,0,0]=4 2296 B14R2.112 FCOc1ccc2ccncc2c1 7a_100000752006_100015361967 [0,2,0,0,0,0|2,0,0]=4 2297 B14R2.112 FCOc1ccc2cnccc2c1 34a_100000046372_100015361967 [0,2,0,0,0,0|2,0,0]=4 2298 B14R2.112 FCOc1ccc2cnccc2c1 7a_100000046372_100015361967 [0,2,0,0,0,0|2,0,0]=4 2299 B14R2.112 FCOc1ccc2ncccc2c1 34a_100011215586_100015361967 [0,2,0,0,0,0|0,0,0]=2 2300 B14R2.112 FCOc1ccc2ncccc2c1 7a_100011215586_100015361967 [0,2,0,0,0,0|0,0,0]=2 2301 B14R2.112 FCOc1ccc2nccnc2c1 34a_100000694412_100015361967 [0,2,0,0,0,0|1,0,0]=3 2302 B14R2.112 FCOc1cnc2ccccc2c1 34a_100011934006_100015361967 [0,2,0,0,0,0|2,0,0]=4 2303 B14R2.112 FCOc1cnc2ccccc2c1 7a_100011934006_100015361967 [0,2,0,0,0,0|2,0,0]=4 2304 B14R2.112 FCSc1cc2ccccc2cn1 62a_100009816522_100015361967 [0,2,0,0,0,0|2,0,0]=4 2305 B14R2.112 FCSc1cc2ccccc2cn1 62a_100015361967_100000047361 [0,2,0,0,0,0|2,0,0]=4 2306 B14R2.112 FCSc1cc2nccnc2cn1 62a_100010370699_100015361967 [0,2,0,0,0,0|2,0,0]=4 2307 B14R2.112 FCSc1cc2nccnc2cn1 62a_100015361967_100010370699 [0,2,0,0,0,0|2,0,0]=4 2308 B14R2.112 FCSc1ccc2ccccc2c1 62a_100015361967_100000233703 [0,2,0,0,0,0|1,0,0]=3 2309 B14R2.112 FCSc1ccc2ccccc2n1 62a_100011291633_100015361967 [0,2,0,0,0,0|2,0,0]=4 2310 B14R2.112 FCSc1ccc2ccccc2n1 62a_100015361967_100011291633 [0,2,0,0,0,0|2,0,0]=4 2311 B14R2.112 FCSc1ccc2cccnc2c1 62a_100015361967_100009816655 [0,2,0,0,0,0|2,0,0]=4 2312 B14R2.112 FCSc1ccc2ccncc2c1 62a_100000686496_100015361967 [0,2,0,0,0,0|2,0,0]=4 2313 B14R2.112 FCSc1ccc2ccncc2c1 62a_100015361967_100000686496 [0,2,0,0,0,0|2,0,0]=4 2314 B14R2.112 FCSc1ccc2cnccc2c1 62a_100009816743_100015361967 [0,2,0,0,0,0|2,0,0]=4 2315 B14R2.112 FCSc1ccc2cnccc2c1 62a_100015361967_100009816743 [0,2,0,0,0,0|2,0,0]=4 2316 B14R2.112 FCSc1ccc2ncccc2c1 62a_100011215947_100015361967 [0,2,0,0,0,0|0,0,0]=2 2317 B14R2.112 FCSc1ccc2ncccc2c1 62a_100015361967_100011215947 [0,2,0,0,0,0|0,0,0]=2 2318 B14R2.112 FCSc1ccc2ncccc2n1 62a_100015361967_100000073381 [0,2,0,0,0,0|1,0,0]=3 2319 B14R2.112 FCSc1ccc2nccnc2c1 62a_100011219451_100015361967 [0,2,0,0,0,0|1,0,0]=3 2320 B14R2.112 FCSc1ccc2nccnc2c1 62a_100015361967_100011219451 [0,2,0,0,0,0|1,0,0]=3 2321 B14R2.112 FCSc1ccc2nccnc2n1 62a_100012351543_100015361967 [0,2,0,0,0,0|2,0,0]=4 2322 B14R2.112 FCSc1ccc2nccnc2n1 62a_100015361967_100012351543 [0,2,0,0,0,0|2,0,0]=4 2323 B14R2.112 FCSc1ccc2ncncc2c1 62a_100009989443_100015361967 [0,2,0,0,0,0|1,0,0]=3 2324 B14R2.112 FCSc1ccc2ncncc2c1 62a_100015361967_100009989443 [0,2,0,0,0,0|1,0,0]=3 2325 B14R2.112 FCSc1ccc2nnccc2c1 62a_100010209549_100015361967 [0,2,0,0,0,0|1,0,0]=3 2326 B14R2.112 FCSc1ccc2nnccc2c1 62a_100015361967_100010209549 [0,2,0,0,0,0|1,0,0]=3 2327 B14R2.112 FCSc1cnc2ccccc2c1 62a_100015361967_100000737414 [0,2,0,0,0,0|2,0,0]=4 2328 B14R2.112 FCSc1cnc2ncccc2n1 62a_100000084304_100015361967 [0,2,0,0,0,0|2,0,0]=4 2329 B14R2.112 FCSc1cnc2ncccc2n1 62a_100015361967_100000084304 [0,2,0,0,0,0|2,0,0]=4 2330 B14R2.112 FCSc1cnc2nccnc2c1 62a_100000753224_100015361967 [0,2,0,0,0,0|2,0,0]=4 2331 B14R2.112 FCSc1cnc2nccnc2c1 62a_100015361967_100000753224 [0,2,0,0,0,0|2,0,0]=4 2332 B14R2.112 [13CH3]NCc1ccc2ccccc2c1 2230a_100000739491_200025704644 [0,2,0,0,0,0|1,0,0]=3 2333 B14R2.112 [13CH3]NCc1ccc2ccccc2c1 34a_100000739491_200025704644 [0,2,0,0,0,0|1,0,0]=3 2334 B14R2.112 [13CH3]NCc1ccc2ncccc2c1 34a_100000238500_200025704644 [0,2,0,0,0,0|0,0,0]=2 2335 B14R2.112 [13CH3]NCc1cnc2ccccc2c1 34a_100000742225_200025704644 [0,2,0,0,0,0|2,0,0]=4 2336 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 34a_100011215330_200025704644 [0,2,0,0,0,0|1,0,0]=3 2337 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 7a_100011215330_200025704644 [0,2,0,0,0,0|1,0,0]=3 2338 B14R2.112 [13CH3]OCc1ccc2ncccc2c1 34a_100011315636_200025704644 [0,2,0,0,0,0|0,0,0]=2 2339 B14R2.112 [13CH3]OCc1cnc2ccccc2c1 34a_100011258773_200025704644 [0,2,0,0,0,0|2,0,0]=4 2340 B14R2.112 [13CH3]SCc1cc2ccccc2cn1 62a_100009869231_200025704644 [0,2,0,0,0,0|2,0,0]=4 2341 B14R2.112 [13CH3]SCc1cc2ccccc2cn1 62a_200025704644_100009869231 [0,2,0,0,0,0|2,0,0]=4 2342 B14R2.112 [13CH3]SCc1ccc2ccccc2c1 62a_100011216711_200025704644 [0,2,0,0,0,0|1,0,0]=3 2343 B14R2.112 [13CH3]SCc1ccc2ccccc2c1 62a_200025704644_100011216711 [0,2,0,0,0,0|1,0,0]=3 2344 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_100000737579_200025704644 [0,2,0,0,0,0|2,0,0]=4 2345 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_200025704644_100000737579 [0,2,0,0,0,0|2,0,0]=4 2346 B14R2.112 [13CH3]SCc1ccc2cnccc2c1 62a_100020605334_200025704644 [0,2,0,0,0,0|2,0,0]=4 2347 B14R2.112 [13CH3]SCc1ccc2cnccc2c1 62a_200025704644_100020605334 [0,2,0,0,0,0|2,0,0]=4 2348 B14R2.112 [13CH3]SCc1ccc2ncccc2c1 62a_100000703657_200025704644 [0,2,0,0,0,0|0,0,0]=2 2349 B14R2.112 [13CH3]SCc1ccc2ncccc2c1 62a_200025704644_100000703657 [0,2,0,0,0,0|0,0,0]=2 2350 B14R2.112 [13CH3]SCc1ccc2nccnc2c1 62a_200011762199_200025704644 [0,2,0,0,0,0|1,0,0]=3 2351 B14R2.112 [13CH3]SCc1ccc2nccnc2c1 62a_200025704644_200011762199 [0,2,0,0,0,0|1,0,0]=3 2352 B14R2.134 C=Cc1ccc2ccc(cc2c1)N 271570a_100011290941_100010090036 [0,2,0,0,0,0|1,0,1]=4 2353 B14R2.134 C=Cc1ccc2ccc(cc2c1)O 271570a_100011290941_100009816537 [0,2,0,0,0,0|1,0,1]=4 2354 B14R2.134 C=Cc1ccc2ccc(nc2c1)C 271570a_100011290941_100009817087 [0,2,0,0,0,0|2,0,0]=4 2355 B14R2.134 C=Cc1ccc2ncc(cc2c1)Br 271570a_100011290941_200010254249 [0,2,0,0,0,0|0,0,1]=3 2356 B14R2.134 C=Cc1ccc2ncc(cc2c1)C 271570a_100011290941_100009817055 [0,2,0,0,0,0|0,0,1]=3 2357 B14R2.134 C=Cc1ccc2ncc(cc2c1)O 271570a_100011290941_100000703654 [0,2,0,0,0,0|0,0,1]=3 2358 B14R2.134 C=Cc1ccc2ncc(cc2n1)F 271570a_100011290941_100009889179 [0,2,0,0,0,0|1,0,1]=4 2359 B14R2.134 C=Cc1ccc2ncc(nc2c1)N 271570a_100011290941_100010090528 [0,2,0,0,0,0|1,0,1]=4 2360 B14R2.134 C=Cc1ccc2ncc(nc2c1)O 271570a_100011290941_100010000190 [0,2,0,0,0,0|1,0,1]=4 2361 B14R2.134 C=Cc1cnc2ccc(cc2c1)Br 271570a_100011290941_100010740133 [0,2,0,0,0,0|1,0,0]=3 2362 B14R2.134 C=Cc1cnc2ccc(cc2c1)C 271570a_100011290941_100015841224 [0,2,0,0,0,0|0,0,0]=2 2363 B14R2.134 C=Cc1cnc2ccc(cc2c1)Cl 271570a_100011290941_100015929906 [0,2,0,0,0,0|1,0,0]=3 2364 B14R2.134 C=Cc1cnc2ccc(cc2c1)N 271570a_100011290941_100009888932 [0,2,0,0,0,0|1,0,0]=3 2365 B14R2.134 C=Cc1cnc2ccc(cc2c1)O 271570a_100011290941_100010137430 [0,2,0,0,0,0|1,0,0]=3 2366 B14R2.134 C=Cc1cnc2ccc(cc2n1)O 271570a_100011290941_200020640061 [0,2,0,0,0,0|2,0,0]=4 2367 B14R2.134 C=Cc1cnc2ccc(nc2c1)O 271570a_100011290941_100010009477 [0,2,0,0,0,0|2,0,0]=4 2368 B14R2.134 CNc1ccc2ccc(cc2c1)Br 34a_100010090036_200000210301 [0,2,0,0,0,0|1,0,0]=3 2369 B14R2.134 CNc1ccc2ccc(cc2c1)Br 7a_100010090036_200000210301 [0,2,0,0,0,0|1,0,0]=3 2370 B14R2.134 CNc1ccc2ccc(cc2c1)O 34a_100015378740_200000210301 [0,2,0,0,0,0|1,0,0]=3 2371 B14R2.134 CNc1ccc2ccc(cc2c1)O 7a_100015378740_200000210301 [0,2,0,0,0,0|1,0,0]=3 2372 B14R2.134 CNc1ccc2ncc(cc2c1)Br 34a_100009888932_200000210301 [0,2,0,0,0,0|0,0,0]=2 2373 B14R2.134 CNc1ccc2ncc(cc2n1)F 27a_100102657272_100009889179 [0,2,0,0,0,0|1,0,0]=3 2374 B14R2.134 CNc1cnc2ccc(cc2n1)O 27a_100102657272_200020640061 [0,2,0,0,0,0|2,0,0]=4 2375 B14R2.134 COc1cc2cc(ccc2cn1)F 34a_200000101709_200000210301 [0,2,0,0,0,0|2,0,0]=4 2376 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [0,2,0,0,0,0|2,0,0]=4 2377 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [0,2,0,0,0,0|2,0,0]=4 2378 B14R2.134 COc1ccc2ccc(cc2c1)Br 34a_100009816537_200000210301 [0,2,0,0,0,0|1,0,0]=3 2379 B14R2.134 COc1ccc2ccc(cc2c1)Br 7a_100009816537_200000210301 [0,2,0,0,0,0|1,0,0]=3 2380 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [0,2,0,0,0,0|1,0,0]=3 2381 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [0,2,0,0,0,0|1,0,0]=3 2382 B14R2.134 COc1ccc2ccc(cc2c1)N 34a_100015378740_200000210301 [0,2,0,0,0,0|1,0,0]=3 2383 B14R2.134 COc1ccc2ccc(cc2c1)N 7a_100015378740_200000210301 [0,2,0,0,0,0|1,0,0]=3 2384 B14R2.134 COc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090027 [0,2,0,0,0,0|1,0,0]=3 2385 B14R2.134 COc1ccc2ccc(cc2n1)O 271570a_203496583355_100010248626 [0,2,0,0,0,0|2,0,0]=4 2386 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [0,2,0,0,0,0|2,0,0]=4 2387 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [0,2,0,0,0,0|2,0,0]=4 2388 B14R2.134 COc1ccc2ccc(nc2c1)Cl 34a_100000079174_200000210301 [0,2,0,0,0,0|2,0,0]=4 2389 B14R2.134 COc1ccc2ccc(nc2c1)Cl 7a_100000079174_200000210301 [0,2,0,0,0,0|2,0,0]=4 2390 B14R2.134 COc1ccc2ccc(nc2c1)O 271570a_203496583355_100009877240 [0,2,0,0,0,0|2,0,0]=4 2391 B14R2.134 COc1ccc2ncc(cc2c1)Br 34a_100010137430_200000210301 [0,2,0,0,0,0|0,0,0]=2 2392 B14R2.134 COc1ccc2ncc(cc2c1)Br 7a_100010137430_200000210301 [0,2,0,0,0,0|0,0,0]=2 2393 B14R2.134 COc1ccc2ncc(cc2c1)Cl 34a_100009869629_200000210301 [0,2,0,0,0,0|0,0,0]=2 2394 B14R2.134 COc1ccc2ncc(cc2c1)Cl 7a_100009869629_200000210301 [0,2,0,0,0,0|0,0,0]=2 2395 B14R2.134 COc1ccc2ncc(cc2c1)F 34a_100009845357_200000210301 [0,2,0,0,0,0|0,0,0]=2 2396 B14R2.134 COc1ccc2ncc(cc2c1)F 7a_100009845357_200000210301 [0,2,0,0,0,0|0,0,0]=2 2397 B14R2.134 COc1ccc2ncc(cc2c1)O 271570a_203496583355_100000700671 [0,2,0,0,0,0|0,0,0]=2 2398 B14R2.134 COc1ccc2ncc(nc2c1)Cl 34a_200020640061_200000210301 [0,2,0,0,0,0|1,0,0]=3 2399 B14R2.134 COc1ccc2ncc(nc2c1)O 271570a_203496583355_100009882714 [0,2,0,0,0,0|1,0,0]=3 2400 B14R2.134 COc1cnc2ccc(cc2c1)Br 34a_100000703654_200000210301 [0,2,0,0,0,0|1,0,0]=3 2401 B14R2.134 COc1cnc2ccc(cc2c1)Br 7a_100000703654_200000210301 [0,2,0,0,0,0|1,0,0]=3 2402 B14R2.134 COc1cnc2ccc(cc2n1)O 271570a_203496583355_100010293655 [0,2,0,0,0,0|2,0,0]=4 2403 B14R2.134 CSc1cc2cc(ccc2cn1)F 62a_100009828686_200000210301 [0,2,0,0,0,0|2,0,0]=4 2404 B14R2.134 CSc1cc2cc(ccc2cn1)F 62a_200000210301_100009828686 [0,2,0,0,0,0|2,0,0]=4 2405 B14R2.134 CSc1ccc2cc[n+](cc2c1)[O-] 62a_200000210301_100009816120 [0,2,0,0,0,0|2,0,0]=4 2406 B14R2.134 CSc1ccc2ccc(=O)oc2c1 62a_200000210301_100009993525 [0,2,0,0,0,0|2,0,0]=4 2407 B14R2.134 CSc1ccc2ccc(cc2c1)N 62a_100010090036_200000210301 [0,2,0,0,0,0|1,0,0]=3 2408 B14R2.134 CSc1ccc2ccc(cc2c1)N 62a_200000210301_100010090036 [0,2,0,0,0,0|1,0,0]=3 2409 B14R2.134 CSc1ccc2ccc(cc2c1)O 62a_200000210301_100009816537 [0,2,0,0,0,0|1,0,0]=3 2410 B14R2.134 CSc1ccc2ccc(cc2n1)O 62a_200000210301_100000079174 [0,2,0,0,0,0|2,0,0]=4 2411 B14R2.134 CSc1ccc2ccc(nc2c1)C 62a_100009817087_200000210301 [0,2,0,0,0,0|2,0,0]=4 2412 B14R2.134 CSc1ccc2ccc(nc2c1)C 62a_200000210301_100009817087 [0,2,0,0,0,0|2,0,0]=4 2413 B14R2.134 CSc1ccc2ccc(nc2c1)N 62a_100010187616_200000210301 [0,2,0,0,0,0|2,0,0]=4 2414 B14R2.134 CSc1ccc2ccc(nc2c1)O 62a_200000210301_100000690401 [0,2,0,0,0,0|2,0,0]=4 2415 B14R2.134 CSc1ccc2cnc(cc2c1)F 62a_100010291885_200000210301 [0,2,0,0,0,0|2,0,0]=4 2416 B14R2.134 CSc1ccc2cnc(cc2c1)F 62a_200000210301_100010291885 [0,2,0,0,0,0|2,0,0]=4 2417 B14R2.134 CSc1ccc2cnc(cc2c1)N 62a_100009817123_200000210301 [0,2,0,0,0,0|2,0,0]=4 2418 B14R2.134 CSc1ccc2cnc(cc2c1)N 62a_200000210301_100009817123 [0,2,0,0,0,0|2,0,0]=4 2419 B14R2.134 CSc1ccc2cnc(cc2c1)O 62a_200000210301_100009817130 [0,2,0,0,0,0|2,0,0]=4 2420 B14R2.134 CSc1ccc2ncc(cc2c1)Br 62a_200000210301_200010254249 [0,2,0,0,0,0|0,0,0]=2 2421 B14R2.134 CSc1ccc2ncc(cc2c1)Br 62a_200010254249_200000210301 [0,2,0,0,0,0|0,0,0]=2 2422 B14R2.134 CSc1ccc2ncc(cc2c1)C 62a_200000210301_100009817055 [0,2,0,0,0,0|0,0,0]=2 2423 B14R2.134 CSc1ccc2ncc(cc2c1)O 62a_200000210301_100000703654 [0,2,0,0,0,0|0,0,0]=2 2424 B14R2.134 CSc1ccc2ncc(cc2n1)F 62a_100009889179_200000210301 [0,2,0,0,0,0|1,0,0]=3 2425 B14R2.134 CSc1ccc2ncc(cc2n1)F 62a_200000210301_100009889179 [0,2,0,0,0,0|1,0,0]=3 2426 B14R2.134 CSc1ccc2ncc(nc2c1)N 62a_100010090528_200000210301 [0,2,0,0,0,0|1,0,0]=3 2427 B14R2.134 CSc1ccc2ncc(nc2c1)N 62a_200000210301_100010090528 [0,2,0,0,0,0|1,0,0]=3 2428 B14R2.134 CSc1ccc2ncc(nc2c1)O 62a_200000210301_100010000190 [0,2,0,0,0,0|1,0,0]=3 2429 B14R2.134 CSc1cnc2ccc(cc2c1)Br 62a_100010740133_200000210301 [0,2,0,0,0,0|1,0,0]=3 2430 B14R2.134 CSc1cnc2ccc(cc2c1)Br 62a_200000210301_100010740133 [0,2,0,0,0,0|1,0,0]=3 2431 B14R2.134 CSc1cnc2ccc(cc2c1)C 62a_200000210301_100015841224 [0,2,0,0,0,0|0,0,0]=2 2432 B14R2.134 CSc1cnc2ccc(cc2c1)Cl 62a_100015929906_200000210301 [0,2,0,0,0,0|1,0,0]=3 2433 B14R2.134 CSc1cnc2ccc(cc2c1)Cl 62a_200000210301_100015929906 [0,2,0,0,0,0|1,0,0]=3 2434 B14R2.134 CSc1cnc2ccc(cc2c1)N 62a_100009888932_200000210301 [0,2,0,0,0,0|1,0,0]=3 2435 B14R2.134 CSc1cnc2ccc(cc2c1)N 62a_200000210301_100009888932 [0,2,0,0,0,0|1,0,0]=3 2436 B14R2.134 CSc1cnc2ccc(cc2c1)O 62a_200000210301_100010137430 [0,2,0,0,0,0|1,0,0]=3 2437 B14R2.134 CSc1cnc2ccc(cc2n1)O 62a_200000210301_200020640061 [0,2,0,0,0,0|2,0,0]=4 2438 B14R2.134 CSc1cnc2ccc(nc2c1)O 62a_200000210301_100010009477 [0,2,0,0,0,0|2,0,0]=4 2439 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [0,2,0,0,0,0|1,0,0]=3 2440 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [0,2,0,0,0,0|1,0,0]=3 2441 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [0,2,0,0,0,0|2,0,0]=4 2442 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [0,2,0,0,0,0|2,0,0]=4 2443 B14R2.134 Cc1ccc2ccc(cc2n1)S[13CH3] 62a_100009817087_200025704644 [0,2,0,0,0,0|2,0,0]=4 2444 B14R2.134 Cc1ccc2ccc(cc2n1)S[13CH3] 62a_200025704644_100009817087 [0,2,0,0,0,0|2,0,0]=4 2445 B14R2.134 Cc1ccc2ncc(cc2c1)S[13CH3] 62a_200025704644_100015841224 [0,2,0,0,0,0|0,0,0]=2 2446 B14R2.134 Cc1cnc2ccc(cc2c1)S[13CH3] 62a_200025704644_100009817055 [0,2,0,0,0,0|0,0,0]=2 2447 B14R2.134 N#Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100010885934 [0,2,0,0,0,0|1,0,0]=3 2448 B14R2.134 O=Cc1ccc2ccc(cc2c1)O 271570a_203496583355_100010200085 [0,2,0,0,0,0|1,0,1]=4 2449 B14R2.134 O=Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100010174008 [0,2,0,0,0,0|1,0,0]=3 2450 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)Br 34a_100010090036_200025704644 [0,2,0,0,0,0|1,0,0]=3 2451 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)Br 7a_100010090036_200025704644 [0,2,0,0,0,0|1,0,0]=3 2452 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 34a_100015378740_200025704644 [0,2,0,0,0,0|1,0,0]=3 2453 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 7a_100015378740_200025704644 [0,2,0,0,0,0|1,0,0]=3 2454 B14R2.134 [13CH3]Nc1ccc2ncc(cc2c1)Br 34a_100009888932_200025704644 [0,2,0,0,0,0|0,0,0]=2 2455 B14R2.134 [13CH3]Oc1cc2cc(ccc2cn1)F 34a_200000101709_200025704644 [0,2,0,0,0,0|2,0,0]=4 2456 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [0,2,0,0,0,0|2,0,0]=4 2457 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [0,2,0,0,0,0|2,0,0]=4 2458 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 34a_100009816537_200025704644 [0,2,0,0,0,0|1,0,0]=3 2459 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 7a_100009816537_200025704644 [0,2,0,0,0,0|1,0,0]=3 2460 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 34a_100015378740_200025704644 [0,2,0,0,0,0|1,0,0]=3 2461 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 7a_100015378740_200025704644 [0,2,0,0,0,0|1,0,0]=3 2462 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_200025704644 [0,2,0,0,0,0|2,0,0]=4 2463 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_200025704644 [0,2,0,0,0,0|2,0,0]=4 2464 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Br 34a_100010137430_200025704644 [0,2,0,0,0,0|0,0,0]=2 2465 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Br 7a_100010137430_200025704644 [0,2,0,0,0,0|0,0,0]=2 2466 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Cl 34a_100009869629_200025704644 [0,2,0,0,0,0|0,0,0]=2 2467 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Cl 7a_100009869629_200025704644 [0,2,0,0,0,0|0,0,0]=2 2468 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)F 34a_100009845357_200025704644 [0,2,0,0,0,0|0,0,0]=2 2469 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)F 7a_100009845357_200025704644 [0,2,0,0,0,0|0,0,0]=2 2470 B14R2.134 [13CH3]Oc1ccc2ncc(nc2c1)Cl 34a_200020640061_200025704644 [0,2,0,0,0,0|1,0,0]=3 2471 B14R2.134 [13CH3]Oc1cnc2ccc(cc2c1)Br 34a_100000703654_200025704644 [0,2,0,0,0,0|1,0,0]=3 2472 B14R2.134 [13CH3]Oc1cnc2ccc(cc2c1)Br 7a_100000703654_200025704644 [0,2,0,0,0,0|1,0,0]=3 2473 B14R2.134 [13CH3]Sc1cc2cc(ccc2cn1)F 62a_100009828686_200025704644 [0,2,0,0,0,0|2,0,0]=4 2474 B14R2.134 [13CH3]Sc1cc2cc(ccc2cn1)F 62a_200025704644_100009828686 [0,2,0,0,0,0|2,0,0]=4 2475 B14R2.134 [13CH3]Sc1ccc2cc[n+](cc2c1)[O-] 62a_200025704644_100009816120 [0,2,0,0,0,0|2,0,0]=4 2476 B14R2.134 [13CH3]Sc1ccc2ccc(=O)oc2c1 62a_200025704644_100009993525 [0,2,0,0,0,0|2,0,0]=4 2477 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)N 62a_100010090036_200025704644 [0,2,0,0,0,0|1,0,0]=3 2478 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)N 62a_200025704644_100010090036 [0,2,0,0,0,0|1,0,0]=3 2479 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)O 62a_200025704644_100009816537 [0,2,0,0,0,0|1,0,0]=3 2480 B14R2.134 [13CH3]Sc1ccc2ccc(cc2n1)O 62a_200025704644_100000079174 [0,2,0,0,0,0|2,0,0]=4 2481 B14R2.134 [13CH3]Sc1ccc2ccc(nc2c1)N 62a_100010187616_200025704644 [0,2,0,0,0,0|2,0,0]=4 2482 B14R2.134 [13CH3]Sc1ccc2ccc(nc2c1)O 62a_200025704644_100000690401 [0,2,0,0,0,0|2,0,0]=4 2483 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)F 62a_100010291885_200025704644 [0,2,0,0,0,0|2,0,0]=4 2484 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)F 62a_200025704644_100010291885 [0,2,0,0,0,0|2,0,0]=4 2485 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)N 62a_100009817123_200025704644 [0,2,0,0,0,0|2,0,0]=4 2486 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)N 62a_200025704644_100009817123 [0,2,0,0,0,0|2,0,0]=4 2487 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)O 62a_200025704644_100009817130 [0,2,0,0,0,0|2,0,0]=4 2488 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)Br 62a_200010254249_200025704644 [0,2,0,0,0,0|0,0,0]=2 2489 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)Br 62a_200025704644_200010254249 [0,2,0,0,0,0|0,0,0]=2 2490 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)O 62a_200025704644_100000703654 [0,2,0,0,0,0|0,0,0]=2 2491 B14R2.134 [13CH3]Sc1ccc2ncc(cc2n1)F 62a_100009889179_200025704644 [0,2,0,0,0,0|1,0,0]=3 2492 B14R2.134 [13CH3]Sc1ccc2ncc(cc2n1)F 62a_200025704644_100009889179 [0,2,0,0,0,0|1,0,0]=3 2493 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)N 62a_100010090528_200025704644 [0,2,0,0,0,0|1,0,0]=3 2494 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)N 62a_200025704644_100010090528 [0,2,0,0,0,0|1,0,0]=3 2495 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)O 62a_200025704644_100010000190 [0,2,0,0,0,0|1,0,0]=3 2496 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)Br 62a_100010740133_200025704644 [0,2,0,0,0,0|1,0,0]=3 2497 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)Br 62a_200025704644_100010740133 [0,2,0,0,0,0|1,0,0]=3 2498 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)Cl 62a_100015929906_200025704644 [0,2,0,0,0,0|1,0,0]=3 2499 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)Cl 62a_200025704644_100015929906 [0,2,0,0,0,0|1,0,0]=3 2500 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)N 62a_100009888932_200025704644 [0,2,0,0,0,0|1,0,0]=3 2501 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)N 62a_200025704644_100009888932 [0,2,0,0,0,0|1,0,0]=3 2502 B14R2.134 [13CH3]Sc1cnc2ccc(cc2c1)O 62a_200025704644_100010137430 [0,2,0,0,0,0|1,0,0]=3 2503 B14R2.134 [13CH3]Sc1cnc2ccc(cc2n1)O 62a_200025704644_200020640061 [0,2,0,0,0,0|2,0,0]=4 2504 B14R2.134 [13CH3]Sc1cnc2ccc(nc2c1)O 62a_200025704644_100010009477 [0,2,0,0,0,0|2,0,0]=4 2505 B14R2.142 C=Cc1ccc2[nH]ccc(=O)c2c1 271570a_100011290941_100000746092 [0,2,0,0,0,0|0,0,2]=4 2506 B14R2.142 C=Cc1ccc2cccc(c2c1)C 271570a_100011290941_100010089936 [0,2,0,0,0,0|1,0,1]=4 2507 B14R2.142 C=Cc1ccc2cccc(c2c1)N 271570a_100011290941_100010090012 [0,2,0,0,0,0|1,0,1]=4 2508 B14R2.142 C=Cc1ccc2cccc(c2c1)O 271570a_100011290941_100010089991 [0,2,0,0,0,0|1,0,1]=4 2509 B14R2.142 C=Cc1ccc2nc[nH]c(=O)c2c1 271570a_100011290941_100000755678 [0,2,0,0,0,0|1,0,1]=4 2510 B14R2.142 C=Cc1ccc2nccc(=O)n2c1 271570a_100011290941_100010178973 [0,2,0,0,0,0|1,0,1]=4 2511 B14R2.142 C=Cc1ccc2nccc(c2c1)C 271570a_100011290941_100009817033 [0,2,0,0,0,0|0,0,1]=3 2512 B14R2.142 C=Cc1ccc2nccc(c2c1)Cl 271570a_100011290941_100011310491 [0,2,0,0,0,0|0,0,1]=3 2513 B14R2.142 C=Cc1ccc2nccc(c2c1)N 271570a_100011290941_100011620571 [0,2,0,0,0,0|0,0,1]=3 2514 B14R2.142 C=Cc1ccc2ncnc(c2c1)C 271570a_100011290941_100000700471 [0,2,0,0,0,0|1,0,1]=4 2515 B14R2.142 C=Cc1ccc2ncnc(c2c1)Cl 271570a_100011290941_100000757566 [0,2,0,0,0,0|1,0,1]=4 2516 B14R2.142 C=Cc1ccc2ncnc(c2c1)N 271570a_100011290941_100011390335 [0,2,0,0,0,0|1,0,1]=4 2517 B14R2.142 C=Cc1ccc2nncc(c2c1)O 271570a_100011290941_100010074700 [0,2,0,0,0,0|1,0,1]=4 2518 B14R2.142 C=Cc1ccc2occc(=O)c2c1 271570a_100011290941_100009813387 [0,2,0,0,0,0|1,0,1]=4 2519 B14R2.142 CNc1ccc2cccc(c2c1)O 34a_100132313934_200000210301 [0,2,0,0,0,0|1,0,0]=3 2520 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [0,2,0,0,0,0|2,0,0]=4 2521 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [0,2,0,0,0,0|2,0,0]=4 2522 B14R2.142 CNc1ccc2nc[nH]c(=O)c2n1 27a_100102657272_100000117605 [0,2,0,0,0,0|2,0,0]=4 2523 B14R2.142 CNc1ccc2nccc(=O)n2n1 27a_100102657272_100000086298 [0,2,0,0,0,0|2,0,0]=4 2524 B14R2.142 CNc1ccc2nccc(c2c1)Br 34a_100010074812_200000210301 [0,2,0,0,0,0|0,0,0]=2 2525 B14R2.142 CNc1ccc2nccc(c2c1)Cl 34a_100009879071_200000210301 [0,2,0,0,0,0|0,0,0]=2 2526 B14R2.142 CNc1ccc2ncnc(c2c1)C 27a_100102657272_100000700471 [0,2,0,0,0,0|1,0,0]=3 2527 B14R2.142 CNc1ccc2ncnc(c2n1)N 27a_100102657272_100011016601 [0,2,0,0,0,0|2,0,0]=4 2528 B14R2.142 CNc1ccc2occc(=O)c2c1 34a_100000088200_200000210301 [0,2,0,0,0,0|1,0,0]=3 2529 B14R2.142 CNc1cnc2nc[nH]c(=O)c2c1 27a_100102657272_100010182796 [0,2,0,0,0,0|2,0,0]=4 2530 B14R2.142 COc1cc2c(cccc2cn1)O 271570a_203496583355_100010126886 [0,2,0,0,0,0|2,0,0]=4 2531 B14R2.142 COc1ccc2cccc(c2c1)Br 34a_100010169565_200000210301 [0,2,0,0,0,0|1,0,0]=3 2532 B14R2.142 COc1ccc2cccc(c2c1)Br 7a_100010169565_200000210301 [0,2,0,0,0,0|1,0,0]=3 2533 B14R2.142 COc1ccc2cccc(c2c1)C 34a_200000091600_200000210301 [0,2,0,0,0,0|1,0,0]=3 2534 B14R2.142 COc1ccc2cccc(c2c1)C 7a_200000091600_200000210301 [0,2,0,0,0,0|1,0,0]=3 2535 B14R2.142 COc1ccc2cccc(c2c1)F 34a_100000091619_200000210301 [0,2,0,0,0,0|1,0,0]=3 2536 B14R2.142 COc1ccc2cccc(c2c1)F 7a_100000091619_200000210301 [0,2,0,0,0,0|1,0,0]=3 2537 B14R2.142 COc1ccc2cccc(c2c1)N 34a_100000034012_200000210301 [0,2,0,0,0,0|1,0,0]=3 2538 B14R2.142 COc1ccc2cccc(c2c1)N 7a_100000034012_200000210301 [0,2,0,0,0,0|1,0,0]=3 2539 B14R2.142 COc1ccc2cccc(c2c1)O 271570a_203496583355_100010178974 [0,2,0,0,0,0|1,0,0]=3 2540 B14R2.142 COc1ccc2ccnc(c2c1)Cl 34a_200009844553_200000210301 [0,2,0,0,0,0|2,0,0]=4 2541 B14R2.142 COc1ccc2ccnc(c2c1)Cl 7a_200009844553_200000210301 [0,2,0,0,0,0|2,0,0]=4 2542 B14R2.142 COc1ccc2ccnc(c2c1)O 271570a_203496583355_100012348807 [0,2,0,0,0,0|2,0,0]=4 2543 B14R2.142 COc1ccc2nc[nH]c(=O)c2c1 7a_100011934087_200000210301 [0,2,0,0,0,0|1,0,0]=3 2544 B14R2.142 COc1ccc2nccc(c2c1)Br 34a_100010204251_200000210301 [0,2,0,0,0,0|0,0,0]=2 2545 B14R2.142 COc1ccc2nccc(c2c1)Br 7a_100010204251_200000210301 [0,2,0,0,0,0|0,0,0]=2 2546 B14R2.142 COc1ccc2nccc(c2c1)Cl 34a_100000075933_200000210301 [0,2,0,0,0,0|0,0,0]=2 2547 B14R2.142 COc1ccc2nccc(c2c1)Cl 7a_100000075933_200000210301 [0,2,0,0,0,0|0,0,0]=2 2548 B14R2.142 COc1ccc2nccc(c2c1)O 271570a_203496583355_100011310462 [0,2,0,0,0,0|0,0,0]=2 2549 B14R2.142 COc1ccc2nccc(c2n1)O 271570a_203496583355_100000090520 [0,2,0,0,0,0|1,0,0]=3 2550 B14R2.142 COc1ccc2ncnc(c2c1)O 271570a_203496583355_100011804145 [0,2,0,0,0,0|1,0,0]=3 2551 B14R2.142 CSc1cc2c(=O)[nH]cnc2cn1 62a_200000210301_100000101234 [0,2,0,0,0,0|2,0,0]=4 2552 B14R2.142 CSc1ccc2[nH]ccc(=O)c2c1 62a_200000210301_100000746092 [0,2,0,0,0,0|0,0,1]=3 2553 B14R2.142 CSc1ccc2cccc(c2c1)C 62a_200000210301_100010089936 [0,2,0,0,0,0|1,0,0]=3 2554 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_100010090012_200000210301 [0,2,0,0,0,0|1,0,0]=3 2555 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_200000210301_100010090012 [0,2,0,0,0,0|1,0,0]=3 2556 B14R2.142 CSc1ccc2cccc(c2c1)O 62a_200000210301_100010089991 [0,2,0,0,0,0|1,0,0]=3 2557 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [0,2,0,0,0,0|2,0,0]=4 2558 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [0,2,0,0,0,0|2,0,0]=4 2559 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [0,2,0,0,0,0|2,0,0]=4 2560 B14R2.142 CSc1ccc2ccnc(c2c1)C 62a_200000210301_200010739692 [0,2,0,0,0,0|2,0,0]=4 2561 B14R2.142 CSc1ccc2ccnc(c2c1)C 62a_200010739692_200000210301 [0,2,0,0,0,0|2,0,0]=4 2562 B14R2.142 CSc1ccc2ccnc(c2c1)N 62a_100012352255_200000210301 [0,2,0,0,0,0|2,0,0]=4 2563 B14R2.142 CSc1ccc2ccnc(c2c1)N 62a_200000210301_100012352255 [0,2,0,0,0,0|2,0,0]=4 2564 B14R2.142 CSc1ccc2ccnc(c2c1)O 62a_200000210301_100000010956 [0,2,0,0,0,0|2,0,0]=4 2565 B14R2.142 CSc1ccc2cncc(c2c1)O 62a_200000210301_100010136424 [0,2,0,0,0,0|2,0,0]=4 2566 B14R2.142 CSc1ccc2nc[nH]c(=O)c2c1 62a_200000210301_100000755678 [0,2,0,0,0,0|1,0,0]=3 2567 B14R2.142 CSc1ccc2nc[nH]c(=O)c2n1 62a_200000210301_100000117605 [0,2,0,0,0,0|2,0,0]=4 2568 B14R2.142 CSc1ccc2nccc(=O)n2c1 62a_100010178973_200000210301 [0,2,0,0,0,0|1,0,0]=3 2569 B14R2.142 CSc1ccc2nccc(=O)n2c1 62a_200000210301_100010178973 [0,2,0,0,0,0|1,0,0]=3 2570 B14R2.142 CSc1ccc2nccc(c2c1)C 62a_100009817033_200000210301 [0,2,0,0,0,0|0,0,0]=2 2571 B14R2.142 CSc1ccc2nccc(c2c1)C 62a_200000210301_100009817033 [0,2,0,0,0,0|0,0,0]=2 2572 B14R2.142 CSc1ccc2nccc(c2c1)Cl 62a_100011310491_200000210301 [0,2,0,0,0,0|0,0,0]=2 2573 B14R2.142 CSc1ccc2nccc(c2c1)Cl 62a_200000210301_100011310491 [0,2,0,0,0,0|0,0,0]=2 2574 B14R2.142 CSc1ccc2nccc(c2c1)N 62a_100011620571_200000210301 [0,2,0,0,0,0|0,0,0]=2 2575 B14R2.142 CSc1ccc2nccc(c2c1)N 62a_200000210301_100011620571 [0,2,0,0,0,0|0,0,0]=2 2576 B14R2.142 CSc1ccc2ncnc(c2c1)C 62a_100000700471_200000210301 [0,2,0,0,0,0|1,0,0]=3 2577 B14R2.142 CSc1ccc2ncnc(c2c1)C 62a_200000210301_100000700471 [0,2,0,0,0,0|1,0,0]=3 2578 B14R2.142 CSc1ccc2ncnc(c2c1)Cl 62a_200000210301_100000757566 [0,2,0,0,0,0|1,0,0]=3 2579 B14R2.142 CSc1ccc2ncnc(c2c1)N 62a_100011390335_200000210301 [0,2,0,0,0,0|1,0,0]=3 2580 B14R2.142 CSc1ccc2ncnc(c2c1)N 62a_200000210301_100011390335 [0,2,0,0,0,0|1,0,0]=3 2581 B14R2.142 CSc1ccc2ncnc(c2n1)N 62a_100011016601_200000210301 [0,2,0,0,0,0|2,0,0]=4 2582 B14R2.142 CSc1ccc2ncnc(c2n1)N 62a_200000210301_100011016601 [0,2,0,0,0,0|2,0,0]=4 2583 B14R2.142 CSc1ccc2nncc(c2c1)O 62a_200000210301_100010074700 [0,2,0,0,0,0|1,0,0]=3 2584 B14R2.142 CSc1ccc2occc(=O)c2c1 62a_200000210301_100009813387 [0,2,0,0,0,0|1,0,0]=3 2585 B14R2.142 CSc1cnc2cccc(c2c1)N 62a_100010264086_200000210301 [0,2,0,0,0,0|2,0,0]=4 2586 B14R2.142 CSc1cnc2cccc(c2c1)N 62a_200000210301_100010264086 [0,2,0,0,0,0|2,0,0]=4 2587 B14R2.142 CSc1cnc2cccc(c2c1)O 62a_200000210301_200010153752 [0,2,0,0,0,0|2,0,0]=4 2588 B14R2.142 CSc1cnc2nc[nH]c(=O)c2c1 62a_100010182796_200000210301 [0,2,0,0,0,0|2,0,0]=4 2589 B14R2.142 CSc1cnc2nc[nH]c(=O)c2c1 62a_200000210301_100010182796 [0,2,0,0,0,0|2,0,0]=4 2590 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 34a_200000091600_200025704644 [0,2,0,0,0,0|1,0,0]=3 2591 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 7a_200000091600_200025704644 [0,2,0,0,0,0|1,0,0]=3 2592 B14R2.142 Cc1cccc2c1cc(cc2)S[13CH3] 62a_200025704644_100010089936 [0,2,0,0,0,0|1,0,0]=3 2593 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [0,2,0,0,0,0|2,0,0]=4 2594 B14R2.142 Cc1ccnc2c1cc(cc2)S[13CH3] 62a_100009817033_200025704644 [0,2,0,0,0,0|0,0,0]=2 2595 B14R2.142 Cc1ccnc2c1cc(cc2)S[13CH3] 62a_200025704644_100009817033 [0,2,0,0,0,0|0,0,0]=2 2596 B14R2.142 Cc1nccc2c1cc(cc2)S[13CH3] 62a_200010739692_200025704644 [0,2,0,0,0,0|2,0,0]=4 2597 B14R2.142 Cc1nccc2c1cc(cc2)S[13CH3] 62a_200025704644_200010739692 [0,2,0,0,0,0|2,0,0]=4 2598 B14R2.142 Cc1ncnc2c1cc(cc2)S[13CH3] 62a_100000700471_200025704644 [0,2,0,0,0,0|1,0,0]=3 2599 B14R2.142 Cc1ncnc2c1cc(cc2)S[13CH3] 62a_200025704644_100000700471 [0,2,0,0,0,0|1,0,0]=3 2600 B14R2.142 N#Cc1ccc2nccc(c2c1)O 271570a_203496583355_100010204249 [0,2,0,0,0,0|0,0,1]=3 2601 B14R2.142 [13CH3]Nc1ccc2cccc(c2c1)O 34a_100132313934_200025704644 [0,2,0,0,0,0|1,0,0]=3 2602 B14R2.142 [13CH3]Nc1ccc2nccc(c2c1)Br 34a_100010074812_200025704644 [0,2,0,0,0,0|0,0,0]=2 2603 B14R2.142 [13CH3]Nc1ccc2nccc(c2c1)Cl 34a_100009879071_200025704644 [0,2,0,0,0,0|0,0,0]=2 2604 B14R2.142 [13CH3]Nc1ccc2occc(=O)c2c1 34a_100000088200_200025704644 [0,2,0,0,0,0|1,0,0]=3 2605 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 34a_100010169565_200025704644 [0,2,0,0,0,0|1,0,0]=3 2606 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 7a_100010169565_200025704644 [0,2,0,0,0,0|1,0,0]=3 2607 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 34a_100000091619_200025704644 [0,2,0,0,0,0|1,0,0]=3 2608 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 7a_100000091619_200025704644 [0,2,0,0,0,0|1,0,0]=3 2609 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 34a_100000034012_200025704644 [0,2,0,0,0,0|1,0,0]=3 2610 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 7a_100000034012_200025704644 [0,2,0,0,0,0|1,0,0]=3 2611 B14R2.142 [13CH3]Oc1ccc2ccnc(c2c1)Cl 34a_200009844553_200025704644 [0,2,0,0,0,0|2,0,0]=4 2612 B14R2.142 [13CH3]Oc1ccc2ccnc(c2c1)Cl 7a_200009844553_200025704644 [0,2,0,0,0,0|2,0,0]=4 2613 B14R2.142 [13CH3]Oc1ccc2nc[nH]c(=O)c2c1 7a_100011934087_200025704644 [0,2,0,0,0,0|1,0,0]=3 2614 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Br 34a_100010204251_200025704644 [0,2,0,0,0,0|0,0,0]=2 2615 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Br 7a_100010204251_200025704644 [0,2,0,0,0,0|0,0,0]=2 2616 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Cl 34a_100000075933_200025704644 [0,2,0,0,0,0|0,0,0]=2 2617 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Cl 7a_100000075933_200025704644 [0,2,0,0,0,0|0,0,0]=2 2618 B14R2.142 [13CH3]Sc1cc2c(=O)[nH]cnc2cn1 62a_200025704644_100000101234 [0,2,0,0,0,0|2,0,0]=4 2619 B14R2.142 [13CH3]Sc1ccc2[nH]ccc(=O)c2c1 62a_200025704644_100000746092 [0,2,0,0,0,0|0,0,1]=3 2620 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_100010090012_200025704644 [0,2,0,0,0,0|1,0,0]=3 2621 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_200025704644_100010090012 [0,2,0,0,0,0|1,0,0]=3 2622 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)O 62a_200025704644_100010089991 [0,2,0,0,0,0|1,0,0]=3 2623 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [0,2,0,0,0,0|2,0,0]=4 2624 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [0,2,0,0,0,0|2,0,0]=4 2625 B14R2.142 [13CH3]Sc1ccc2ccnc(c2c1)N 62a_100012352255_200025704644 [0,2,0,0,0,0|2,0,0]=4 2626 B14R2.142 [13CH3]Sc1ccc2ccnc(c2c1)N 62a_200025704644_100012352255 [0,2,0,0,0,0|2,0,0]=4 2627 B14R2.142 [13CH3]Sc1ccc2ccnc(c2c1)O 62a_200025704644_100000010956 [0,2,0,0,0,0|2,0,0]=4 2628 B14R2.142 [13CH3]Sc1ccc2cncc(c2c1)O 62a_200025704644_100010136424 [0,2,0,0,0,0|2,0,0]=4 2629 B14R2.142 [13CH3]Sc1ccc2nc[nH]c(=O)c2c1 62a_200025704644_100000755678 [0,2,0,0,0,0|1,0,0]=3 2630 B14R2.142 [13CH3]Sc1ccc2nc[nH]c(=O)c2n1 62a_200025704644_100000117605 [0,2,0,0,0,0|2,0,0]=4 2631 B14R2.142 [13CH3]Sc1ccc2nccc(=O)n2c1 62a_100010178973_200025704644 [0,2,0,0,0,0|1,0,0]=3 2632 B14R2.142 [13CH3]Sc1ccc2nccc(=O)n2c1 62a_200025704644_100010178973 [0,2,0,0,0,0|1,0,0]=3 2633 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)Cl 62a_100011310491_200025704644 [0,2,0,0,0,0|0,0,0]=2 2634 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)Cl 62a_200025704644_100011310491 [0,2,0,0,0,0|0,0,0]=2 2635 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)N 62a_100011620571_200025704644 [0,2,0,0,0,0|0,0,0]=2 2636 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)N 62a_200025704644_100011620571 [0,2,0,0,0,0|0,0,0]=2 2637 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)Cl 62a_200025704644_100000757566 [0,2,0,0,0,0|1,0,0]=3 2638 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)N 62a_100011390335_200025704644 [0,2,0,0,0,0|1,0,0]=3 2639 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)N 62a_200025704644_100011390335 [0,2,0,0,0,0|1,0,0]=3 2640 B14R2.142 [13CH3]Sc1ccc2ncnc(c2n1)N 62a_100011016601_200025704644 [0,2,0,0,0,0|2,0,0]=4 2641 B14R2.142 [13CH3]Sc1ccc2ncnc(c2n1)N 62a_200025704644_100011016601 [0,2,0,0,0,0|2,0,0]=4 2642 B14R2.142 [13CH3]Sc1ccc2nncc(c2c1)O 62a_200025704644_100010074700 [0,2,0,0,0,0|1,0,0]=3 2643 B14R2.142 [13CH3]Sc1ccc2occc(=O)c2c1 62a_200025704644_100009813387 [0,2,0,0,0,0|1,0,0]=3 2644 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)N 62a_100010264086_200025704644 [0,2,0,0,0,0|2,0,0]=4 2645 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)N 62a_200025704644_100010264086 [0,2,0,0,0,0|2,0,0]=4 2646 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)O 62a_200025704644_200010153752 [0,2,0,0,0,0|2,0,0]=4 2647 B14R2.142 [13CH3]Sc1cnc2nc[nH]c(=O)c2c1 62a_100010182796_200025704644 [0,2,0,0,0,0|2,0,0]=4 2648 B14R2.142 [13CH3]Sc1cnc2nc[nH]c(=O)c2c1 62a_200025704644_100010182796 [0,2,0,0,0,0|2,0,0]=4 2649 B14R2.781 C=C(C)c1cc2ccccc2cn1 271570a_100000694244_100000047361 [0,2,0,0,0,0|2,0,0]=4 2650 B14R2.781 C=C(C)c1cc2nccnc2cn1 271570a_100000694244_100010370699 [0,2,0,0,0,0|2,0,0]=4 2651 B14R2.781 C=C(C)c1ccc2ccccc2c1 271570a_100000694244_100000233703 [0,2,0,0,0,0|1,0,0]=3 2652 B14R2.781 C=C(C)c1ccc2ccccc2n1 271570a_100000694244_100011291633 [0,2,0,0,0,0|2,0,0]=4 2653 B14R2.781 C=C(C)c1ccc2cccnc2c1 271570a_100000694244_100009816655 [0,2,0,0,0,0|2,0,0]=4 2654 B14R2.781 C=C(C)c1ccc2ccncc2c1 271570a_100000694244_100000686496 [0,2,0,0,0,0|2,0,0]=4 2655 B14R2.781 C=C(C)c1ccc2cnccc2c1 271570a_100000694244_100009816743 [0,2,0,0,0,0|2,0,0]=4 2656 B14R2.781 C=C(C)c1ccc2ncccc2c1 271570a_100000694244_100000754243 [0,2,0,0,0,0|0,0,0]=2 2657 B14R2.781 C=C(C)c1ccc2ncccc2n1 271570a_100000694244_100000073381 [0,2,0,0,0,0|1,0,0]=3 2658 B14R2.781 C=C(C)c1ccc2nccnc2c1 271570a_100000694244_100011219451 [0,2,0,0,0,0|1,0,0]=3 2659 B14R2.781 C=C(C)c1ccc2nccnc2n1 271570a_100000694244_100012351543 [0,2,0,0,0,0|2,0,0]=4 2660 B14R2.781 C=C(C)c1ccc2ncncc2c1 271570a_100000694244_100009989443 [0,2,0,0,0,0|1,0,0]=3 2661 B14R2.781 C=C(C)c1ccc2nnccc2c1 271570a_100000694244_100010209549 [0,2,0,0,0,0|1,0,0]=3 2662 B14R2.781 C=C(C)c1cnc2ccccc2c1 271570a_100000694244_100000737414 [0,2,0,0,0,0|2,0,0]=4 2663 B14R2.781 C=C(C)c1cnc2ncccc2n1 271570a_100000694244_100000084304 [0,2,0,0,0,0|2,0,0]=4 2664 B14R2.781 C=C(C)c1cnc2nccnc2c1 271570a_100000694244_100000753224 [0,2,0,0,0,0|2,0,0]=4 2665 B14R2.781 CC(=O)c1ccc2ccccc2c1 1458a_100000210637_200000210301 [0,2,0,0,0,0|1,0,0]=3 2666 B14R2.781 CC(=O)c1ccc2cccnc2c1 1458a_100011933907_200000210301 [0,2,0,0,0,0|2,0,0]=4 2667 B14R2.781 CC(=O)c1ccc2ccncc2c1 1458a_100000070124_200000210301 [0,2,0,0,0,0|2,0,0]=4 2668 B14R2.781 CC(=O)c1ccc2cnccc2c1 1458a_100011935275_200000210301 [0,2,0,0,0,0|2,0,0]=4 2669 B14R2.781 CC(=O)c1ccc2ncccc2c1 1458a_100011216044_200000210301 [0,2,0,0,0,0|0,0,0]=2 2670 B14R2.781 CC(=O)c1ccc2nccnc2c1 1458a_100000184533_200000210301 [0,2,0,0,0,0|1,0,0]=3 2671 B14R2.781 CN(C)c1cc2nccnc2cn1 27a_100102631434_100000070204 [0,2,0,0,0,0|2,0,0]=4 2672 B14R2.781 CN(C)c1ccc2ccccc2c1 2230a_100000181211_200000210301 [0,2,0,0,0,0|1,0,0]=3 2673 B14R2.781 CN(C)c1ccc2ccccc2c1 269982a_100000181211_200000210301 [0,2,0,0,0,0|1,0,0]=3 2674 B14R2.781 CN(C)c1ccc2ccccc2c1 34a_100000181211_200000210301 [0,2,0,0,0,0|1,0,0]=3 2675 B14R2.781 CN(C)c1ccc2ccccc2n1 27a_100102631434_100011291633 [0,2,0,0,0,0|2,0,0]=4 2676 B14R2.781 CN(C)c1ccc2ncccc2n1 27a_100102631434_100000073381 [0,2,0,0,0,0|1,0,0]=3 2677 B14R2.781 CN(C)c1ccc2nccnc2c1 27a_100102631434_100011219451 [0,2,0,0,0,0|1,0,0]=3 2678 B14R2.781 CN(C)c1ccc2nccnc2n1 27a_100102631434_100012351543 [0,2,0,0,0,0|2,0,0]=4 2679 B14R2.781 CN(C)c1cnc2ncccc2n1 27a_100102631434_100000084304 [0,2,0,0,0,0|2,0,0]=4 2680 B14R2.781 CN(C)c1cnc2nccnc2c1 27a_100102631434_100000753224 [0,2,0,0,0,0|2,0,0]=4 2681 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 2230a_100000181211_200025704644 [0,2,0,0,0,0|1,0,0]=3 2682 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 269982a_100000181211_200025704644 [0,2,0,0,0,0|1,0,0]=3 2683 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 34a_100000181211_200025704644 [0,2,0,0,0,0|1,0,0]=3 2684 B14R2.781 [13CH3]C(=O)c1ccc2ccccc2c1 1458a_100000210637_200025704644 [0,2,0,0,0,0|1,0,0]=3 2685 B14R2.781 [13CH3]C(=O)c1ccc2cccnc2c1 1458a_100011933907_200025704644 [0,2,0,0,0,0|2,0,0]=4 2686 B14R2.781 [13CH3]C(=O)c1ccc2ccncc2c1 1458a_100000070124_200025704644 [0,2,0,0,0,0|2,0,0]=4 2687 B14R2.781 [13CH3]C(=O)c1ccc2cnccc2c1 1458a_100011935275_200025704644 [0,2,0,0,0,0|2,0,0]=4 2688 B14R2.781 [13CH3]C(=O)c1ccc2ncccc2c1 1458a_100011216044_200025704644 [0,2,0,0,0,0|0,0,0]=2 2689 B14R2.781 [13CH3]C(=O)c1ccc2nccnc2c1 1458a_100000184533_200025704644 [0,2,0,0,0,0|1,0,0]=3 2690 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [0,2,0,0,0,0|1,0,1]=4 2691 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [0,2,0,0,0,0|1,0,1]=4 2692 B14R2.1019 C=Cc1cc(c2ncccc2c1)C 271570a_100011290941_100010130319 [0,2,0,0,0,0|0,0,1]=3 2693 B14R2.1019 C=Cc1cc(c2ncccc2c1)Cl 271570a_100011290941_200010369337 [0,2,0,0,0,0|0,0,1]=3 2694 B14R2.1019 C=Cc1cc(c2ncccc2c1)F 271570a_100011290941_100010234705 [0,2,0,0,0,0|0,0,1]=3 2695 B14R2.1019 C=Cc1cc(c2ncccc2c1)N 271570a_100011290941_100009814519 [0,2,0,0,0,0|0,0,1]=3 2696 B14R2.1019 C=Cc1cc(c2ncccc2c1)O 271570a_100011290941_100010248853 [0,2,0,0,0,0|0,0,1]=3 2697 B14R2.1019 C=Cc1cc(c2nccnc2c1)C 271570a_100011290941_100010080486 [0,2,0,0,0,0|1,0,1]=4 2698 B14R2.1019 C=Cc1cc(c2nccnc2c1)F 271570a_100011290941_100010079260 [0,2,0,0,0,0|1,0,1]=4 2699 B14R2.1019 CNc1cc(c2ccccc2c1)Br 34a_100010089974_200000210301 [0,2,0,0,0,0|1,0,0]=3 2700 B14R2.1019 CNc1cc(c2ccccc2c1)Br 7a_100010089974_200000210301 [0,2,0,0,0,0|1,0,0]=3 2701 B14R2.1019 CNc1cc(c2ccccc2n1)C 27a_100102657272_100000184993 [0,2,0,0,0,0|2,0,0]=4 2702 B14R2.1019 CNc1cc(c2cnccc2c1)F 27a_100102657272_100011068762 [0,2,0,0,0,0|2,0,0]=4 2703 B14R2.1019 CNc1cc(c2ncccc2c1)Cl 34a_200009830422_200000210301 [0,2,0,0,0,0|0,0,0]=2 2704 B14R2.1019 CNc1cc(c2nccnc2c1)C 27a_100102657272_100010080486 [0,2,0,0,0,0|1,0,0]=3 2705 B14R2.1019 CNc1cc(c2nccnc2c1)F 27a_100102657272_100010079260 [0,2,0,0,0,0|1,0,0]=3 2706 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [0,2,0,0,0,0|1,0,0]=3 2707 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [0,2,0,0,0,0|1,0,0]=3 2708 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [0,2,0,0,0,0|1,0,0]=3 2709 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [0,2,0,0,0,0|2,0,0]=4 2710 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [0,2,0,0,0,0|2,0,0]=4 2711 B14R2.1019 COc1cc(c2cnccc2c1)Br 34a_100011009069_200000210301 [0,2,0,0,0,0|2,0,0]=4 2712 B14R2.1019 COc1cc(c2cnccc2c1)Br 7a_100011009069_200000210301 [0,2,0,0,0,0|2,0,0]=4 2713 B14R2.1019 COc1cc(c2ncccc2c1)Cl 34a_100000097192_200000210301 [0,2,0,0,0,0|0,0,0]=2 2714 B14R2.1019 COc1cc(c2ncccc2c1)Cl 7a_100000097192_200000210301 [0,2,0,0,0,0|0,0,0]=2 2715 B14R2.1019 COc1cc(c2ncccc2c1)F 34a_100009888031_200000210301 [0,2,0,0,0,0|0,0,0]=2 2716 B14R2.1019 COc1cc(c2ncccc2c1)F 7a_100009888031_200000210301 [0,2,0,0,0,0|0,0,0]=2 2717 B14R2.1019 COc1cc(c2ncccc2c1)N 34a_100000083691_200000210301 [0,2,0,0,0,0|0,0,0]=2 2718 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [0,2,0,0,0,0|0,0,0]=2 2719 B14R2.1019 CSc1cc(=O)c2ccccc2[nH]1 62a_200000210301_100000090176 [0,2,0,0,0,0|2,0,0]=4 2720 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_100010171453_200000210301 [0,2,0,0,0,0|1,0,0]=3 2721 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_200000210301_100010171453 [0,2,0,0,0,0|1,0,0]=3 2722 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [0,2,0,0,0,0|1,0,0]=3 2723 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_100012354972_200000210301 [0,2,0,0,0,0|2,0,0]=4 2724 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_200000210301_100000184993 [0,2,0,0,0,0|2,0,0]=4 2725 B14R2.1019 CSc1cc(c2ccccc2n1)N 62a_100010197925_200000210301 [0,2,0,0,0,0|2,0,0]=4 2726 B14R2.1019 CSc1cc(c2cccnc2c1)N 62a_200000210301_200010263263 [0,2,0,0,0,0|2,0,0]=4 2727 B14R2.1019 CSc1cc(c2cccnc2c1)N 62a_200010263263_200000210301 [0,2,0,0,0,0|2,0,0]=4 2728 B14R2.1019 CSc1cc(c2cnccc2c1)F 62a_100011068762_200000210301 [0,2,0,0,0,0|2,0,0]=4 2729 B14R2.1019 CSc1cc(c2cnccc2c1)F 62a_200000210301_100011068762 [0,2,0,0,0,0|2,0,0]=4 2730 B14R2.1019 CSc1cc(c2ncccc2c1)C 62a_200000210301_100010130319 [0,2,0,0,0,0|0,0,0]=2 2731 B14R2.1019 CSc1cc(c2ncccc2c1)Cl 62a_200000210301_200010369337 [0,2,0,0,0,0|0,0,0]=2 2732 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_100010234705_200000210301 [0,2,0,0,0,0|0,0,0]=2 2733 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_200000210301_100010234705 [0,2,0,0,0,0|0,0,0]=2 2734 B14R2.1019 CSc1cc(c2ncccc2c1)N 62a_200000210301_100009814519 [0,2,0,0,0,0|0,0,0]=2 2735 B14R2.1019 CSc1cc(c2ncccc2c1)O 62a_200000210301_100010248853 [0,2,0,0,0,0|0,0,0]=2 2736 B14R2.1019 CSc1cc(c2nccnc2c1)C 62a_200000210301_100010080486 [0,2,0,0,0,0|1,0,0]=3 2737 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_100010079260_200000210301 [0,2,0,0,0,0|1,0,0]=3 2738 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_200000210301_100010079260 [0,2,0,0,0,0|1,0,0]=3 2739 B14R2.1019 CSc1cc2ccccc2c(=O)[nH]1 62a_200000210301_200015811170 [0,2,0,0,0,0|2,0,0]=4 2740 B14R2.1019 CSc1cc2ccccc2c(n1)N 62a_100009957331_200000210301 [0,2,0,0,0,0|2,0,0]=4 2741 B14R2.1019 CSc1cc2ccccc2c(n1)N 62a_200000210301_100009957331 [0,2,0,0,0,0|2,0,0]=4 2742 B14R2.1019 Cc1cc(cc2c1nccc2)S[13CH3] 62a_200025704644_100010130319 [0,2,0,0,0,0|0,0,0]=2 2743 B14R2.1019 Cc1cc(cc2c1nccn2)S[13CH3] 62a_200025704644_100010080486 [0,2,0,0,0,0|1,0,0]=3 2744 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_100012354972_200025704644 [0,2,0,0,0,0|2,0,0]=4 2745 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_200025704644_100000184993 [0,2,0,0,0,0|2,0,0]=4 2746 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 34a_100010089974_200025704644 [0,2,0,0,0,0|1,0,0]=3 2747 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 7a_100010089974_200025704644 [0,2,0,0,0,0|1,0,0]=3 2748 B14R2.1019 [13CH3]Nc1cc(c2ncccc2c1)Cl 34a_200009830422_200025704644 [0,2,0,0,0,0|0,0,0]=2 2749 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [0,2,0,0,0,0|1,0,0]=3 2750 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [0,2,0,0,0,0|1,0,0]=3 2751 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 34a_100011009069_200025704644 [0,2,0,0,0,0|2,0,0]=4 2752 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 7a_100011009069_200025704644 [0,2,0,0,0,0|2,0,0]=4 2753 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 34a_100000097192_200025704644 [0,2,0,0,0,0|0,0,0]=2 2754 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 7a_100000097192_200025704644 [0,2,0,0,0,0|0,0,0]=2 2755 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 34a_100009888031_200025704644 [0,2,0,0,0,0|0,0,0]=2 2756 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 7a_100009888031_200025704644 [0,2,0,0,0,0|0,0,0]=2 2757 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)N 34a_100000083691_200025704644 [0,2,0,0,0,0|0,0,0]=2 2758 B14R2.1019 [13CH3]Sc1cc(=O)c2ccccc2[nH]1 62a_200025704644_100000090176 [0,2,0,0,0,0|2,0,0]=4 2759 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_100010171453_200025704644 [0,2,0,0,0,0|1,0,0]=3 2760 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_200025704644_100010171453 [0,2,0,0,0,0|1,0,0]=3 2761 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [0,2,0,0,0,0|1,0,0]=3 2762 B14R2.1019 [13CH3]Sc1cc(c2ccccc2n1)N 62a_100010197925_200025704644 [0,2,0,0,0,0|2,0,0]=4 2763 B14R2.1019 [13CH3]Sc1cc(c2cccnc2c1)N 62a_200010263263_200025704644 [0,2,0,0,0,0|2,0,0]=4 2764 B14R2.1019 [13CH3]Sc1cc(c2cccnc2c1)N 62a_200025704644_200010263263 [0,2,0,0,0,0|2,0,0]=4 2765 B14R2.1019 [13CH3]Sc1cc(c2cnccc2c1)F 62a_100011068762_200025704644 [0,2,0,0,0,0|2,0,0]=4 2766 B14R2.1019 [13CH3]Sc1cc(c2cnccc2c1)F 62a_200025704644_100011068762 [0,2,0,0,0,0|2,0,0]=4 2767 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)Cl 62a_200025704644_200010369337 [0,2,0,0,0,0|0,0,0]=2 2768 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_100010234705_200025704644 [0,2,0,0,0,0|0,0,0]=2 2769 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_200025704644_100010234705 [0,2,0,0,0,0|0,0,0]=2 2770 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)N 62a_200025704644_100009814519 [0,2,0,0,0,0|0,0,0]=2 2771 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)O 62a_200025704644_100010248853 [0,2,0,0,0,0|0,0,0]=2 2772 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_100010079260_200025704644 [0,2,0,0,0,0|1,0,0]=3 2773 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_200025704644_100010079260 [0,2,0,0,0,0|1,0,0]=3 2774 B14R2.1019 [13CH3]Sc1cc2ccccc2c(=O)[nH]1 62a_200025704644_200015811170 [0,2,0,0,0,0|2,0,0]=4 2775 B14R2.1019 [13CH3]Sc1cc2ccccc2c(n1)N 62a_100009957331_200025704644 [0,2,0,0,0,0|2,0,0]=4 2776 B14R2.1019 [13CH3]Sc1cc2ccccc2c(n1)N 62a_200025704644_100009957331 [0,2,0,0,0,0|2,0,0]=4 2777 B14R2.1128 C=Cc1cc2ccccc2cc1Br 271570a_100011290941_200010169544 [0,2,0,0,0,0|1,0,1]=4 2778 B14R2.1128 C=Cc1cc2ccccc2cc1Cl 271570a_100011290941_100010152806 [0,2,0,0,0,0|1,0,1]=4 2779 B14R2.1128 C=Cc1cc2ccccc2cc1N 271570a_100011290941_100009991566 [0,2,0,0,0,0|1,0,1]=4 2780 B14R2.1128 C=Cc1cc2ccccc2cc1O 271570a_100011290941_100009817189 [0,2,0,0,0,0|1,0,1]=4 2781 B14R2.1128 C=Cc1cc2cccnc2cc1C 271570a_100011290941_100010137429 [0,2,0,0,0,0|0,0,1]=3 2782 B14R2.1128 C=Cc1cc2cccnc2cc1F 271570a_100011290941_100009854028 [0,2,0,0,0,0|0,0,1]=3 2783 B14R2.1128 C=Cc1cc2ncccc2cc1O 271570a_100011290941_200010153759 [0,2,0,0,0,0|1,0,0]=3 2784 B14R2.1128 C=Cc1cc2nccnc2cc1C 271570a_100011290941_100010080479 [0,2,0,0,0,0|1,0,0]=3 2785 B14R2.1128 C=Cc1cc2nccnc2cc1F 271570a_100011290941_100010080477 [0,2,0,0,0,0|1,0,1]=4 2786 B14R2.1128 C=Cc1cc2nccnc2nc1C 271570a_100011290941_100010212747 [0,2,0,0,0,0|2,0,0]=4 2787 B14R2.1128 C=Cc1nc2ccccc2cc1C 271570a_100011290941_100000751756 [0,2,0,0,0,0|2,0,0]=4 2788 B14R2.1128 C=Cc1nc2ncccc2cc1C 271570a_100011290941_100009877248 [0,2,0,0,0,0|1,0,0]=3 2789 B14R2.1128 CCc1cc2ccccc2nc1O 271570a_203496583355_100011829826 [0,2,0,0,0,0|2,0,0]=4 2790 B14R2.1128 CNc1cc2ccccc2cc1Br 34a_100009991566_200000210301 [0,2,0,0,0,0|1,0,0]=3 2791 B14R2.1128 CNc1cc2ccccc2cc1Br 7a_100009991566_200000210301 [0,2,0,0,0,0|1,0,0]=3 2792 B14R2.1128 CNc1cc2nccnc2cc1C 27a_100102657272_100010080479 [0,2,0,0,0,0|1,0,0]=3 2793 B14R2.1128 CNc1cc2nccnc2cc1F 27a_100102657272_100010080477 [0,2,0,0,0,0|1,0,0]=3 2794 B14R2.1128 CNc1nc2ccccc2cc1C 27a_100102657272_100000751756 [0,2,0,0,0,0|2,0,0]=4 2795 B14R2.1128 CNc1nc2ncccc2cc1C 27a_100102657272_100009877248 [0,2,0,0,0,0|1,0,0]=3 2796 B14R2.1128 COc1cc2ccccc2cc1Br 34a_100009817189_200000210301 [0,2,0,0,0,0|1,0,0]=3 2797 B14R2.1128 COc1cc2ccccc2cc1Br 7a_100009817189_200000210301 [0,2,0,0,0,0|1,0,0]=3 2798 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [0,2,0,0,0,0|1,0,0]=3 2799 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [0,2,0,0,0,0|1,0,0]=3 2800 B14R2.1128 COc1cc2ccccc2cc1N 34a_106744474703_200000210301 [0,2,0,0,0,0|1,0,0]=3 2801 B14R2.1128 COc1cc2ccccc2cc1N 7a_106744474703_200000210301 [0,2,0,0,0,0|1,0,0]=3 2802 B14R2.1128 COc1cc2ccccc2cc1O 271570a_203496583355_100009817100 [0,2,0,0,0,0|1,0,0]=3 2803 B14R2.1128 COc1cc2ccccc2nc1C 34a_200000079175_200000210301 [0,2,0,0,0,0|2,0,0]=4 2804 B14R2.1128 COc1cc2ccccc2nc1C 7a_200000079175_200000210301 [0,2,0,0,0,0|2,0,0]=4 2805 B14R2.1128 COc1cc2ccccc2nc1Cl 34a_200000100762_200000210301 [0,2,0,0,0,0|2,0,0]=4 2806 B14R2.1128 COc1cc2ccccc2nc1Cl 7a_200000100762_200000210301 [0,2,0,0,0,0|2,0,0]=4 2807 B14R2.1128 COc1cc2ccccc2oc1=O 7a_100000061252_200000210301 [0,2,0,0,0,0|2,0,0]=4 2808 B14R2.1128 COc1cc2cccnc2cc1Br 34a_200010153759_200000210301 [0,2,0,0,0,0|0,0,0]=2 2809 B14R2.1128 COc1cc2cccnc2cc1Br 7a_200010153759_200000210301 [0,2,0,0,0,0|0,0,0]=2 2810 B14R2.1128 COc1cc2cccnc2cc1O 271570a_203496583355_100011093944 [0,2,0,0,0,0|0,0,0]=2 2811 B14R2.1128 COc1cc2ccncc2cc1O 271570a_203496583355_100010990640 [0,2,0,0,0,0|2,0,0]=4 2812 B14R2.1128 COc1cc2ncccc2cc1O 271570a_203496583355_100020706834 [0,2,0,0,0,0|1,0,0]=3 2813 B14R2.1128 COc1nc2ccccc2cc1O 271570a_203496583355_100009820890 [0,2,0,0,0,0|2,0,0]=4 2814 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200000210301_200010169544 [0,2,0,0,0,0|1,0,0]=3 2815 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200010169544_200000210301 [0,2,0,0,0,0|1,0,0]=3 2816 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_100010152806_200000210301 [0,2,0,0,0,0|1,0,0]=3 2817 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_200000210301_100010152806 [0,2,0,0,0,0|1,0,0]=3 2818 B14R2.1128 CSc1cc2ccccc2cc1N 62a_100009991566_200000210301 [0,2,0,0,0,0|1,0,0]=3 2819 B14R2.1128 CSc1cc2ccccc2cc1N 62a_200000210301_100009991566 [0,2,0,0,0,0|1,0,0]=3 2820 B14R2.1128 CSc1cc2ccccc2cc1O 62a_200000210301_100009817189 [0,2,0,0,0,0|1,0,0]=3 2821 B14R2.1128 CSc1cc2ccccc2nc1Cl 62a_200000210301_100010220712 [0,2,0,0,0,0|2,0,0]=4 2822 B14R2.1128 CSc1cc2ccccc2nc1F 62a_100011158909_200000210301 [0,2,0,0,0,0|2,0,0]=4 2823 B14R2.1128 CSc1cc2ccccc2nc1F 62a_200000210301_100011158909 [0,2,0,0,0,0|2,0,0]=4 2824 B14R2.1128 CSc1cc2ccccc2nc1N 62a_100010135404_200000210301 [0,2,0,0,0,0|2,0,0]=4 2825 B14R2.1128 CSc1cc2ccccc2nc1O 62a_200000210301_200009820883 [0,2,0,0,0,0|2,0,0]=4 2826 B14R2.1128 CSc1cc2ccccc2oc1=O 62a_200000210301_200000187772 [0,2,0,0,0,0|2,0,0]=4 2827 B14R2.1128 CSc1cc2cccnc2cc1C 62a_100010137429_200000210301 [0,2,0,0,0,0|0,0,0]=2 2828 B14R2.1128 CSc1cc2cccnc2cc1C 62a_200000210301_100010137429 [0,2,0,0,0,0|0,0,0]=2 2829 B14R2.1128 CSc1cc2cccnc2cc1F 62a_100009854028_200000210301 [0,2,0,0,0,0|0,0,0]=2 2830 B14R2.1128 CSc1cc2cccnc2cc1F 62a_200000210301_100009854028 [0,2,0,0,0,0|0,0,0]=2 2831 B14R2.1128 CSc1cc2ccncc2cc1F 62a_100011105921_200000210301 [0,2,0,0,0,0|2,0,0]=4 2832 B14R2.1128 CSc1cc2ccncc2cc1F 62a_200000210301_100011105921 [0,2,0,0,0,0|2,0,0]=4 2833 B14R2.1128 CSc1cc2cnccc2cc1F 62a_100010244713_200000210301 [0,2,0,0,0,0|2,0,0]=4 2834 B14R2.1128 CSc1cc2cnccc2cc1F 62a_200000210301_100010244713 [0,2,0,0,0,0|2,0,0]=4 2835 B14R2.1128 CSc1cc2ncccc2cc1O 62a_200000210301_200010153759 [0,2,0,0,0,0|1,0,0]=3 2836 B14R2.1128 CSc1cc2nccnc2cc1C 62a_100010080479_200000210301 [0,2,0,0,0,0|1,0,0]=3 2837 B14R2.1128 CSc1cc2nccnc2cc1C 62a_200000210301_100010080479 [0,2,0,0,0,0|1,0,0]=3 2838 B14R2.1128 CSc1cc2nccnc2cc1F 62a_100010080477_200000210301 [0,2,0,0,0,0|1,0,0]=3 2839 B14R2.1128 CSc1cc2nccnc2cc1F 62a_200000210301_100010080477 [0,2,0,0,0,0|1,0,0]=3 2840 B14R2.1128 CSc1cc2nccnc2nc1C 62a_100010212747_200000210301 [0,2,0,0,0,0|2,0,0]=4 2841 B14R2.1128 CSc1cc2nccnc2nc1C 62a_200000210301_100010212747 [0,2,0,0,0,0|2,0,0]=4 2842 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_100010072790_200000210301 [0,2,0,0,0,0|2,0,0]=4 2843 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_200000210301_100010072790 [0,2,0,0,0,0|2,0,0]=4 2844 B14R2.1128 CSc1nc2ccccc2cc1C 62a_200000210301_100000751756 [0,2,0,0,0,0|2,0,0]=4 2845 B14R2.1128 CSc1nc2ccccc2cc1O 62a_200000210301_200000100762 [0,2,0,0,0,0|2,0,0]=4 2846 B14R2.1128 CSc1nc2ncccc2cc1C 62a_200000210301_100009877248 [0,2,0,0,0,0|1,0,0]=3 2847 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [0,2,0,0,0,0|1,0,0]=3 2848 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [0,2,0,0,0,0|1,0,0]=3 2849 B14R2.1128 Cc1cc2ccccc2nc1S[13CH3] 62a_200025704644_100000751756 [0,2,0,0,0,0|2,0,0]=4 2850 B14R2.1128 Cc1cc2cccnc2nc1S[13CH3] 62a_200025704644_100009877248 [0,2,0,0,0,0|1,0,0]=3 2851 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_100010137429_200025704644 [0,2,0,0,0,0|0,0,0]=2 2852 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_200025704644_100010137429 [0,2,0,0,0,0|0,0,0]=2 2853 B14R2.1128 Cc1cc2nccnc2cc1S[13CH3] 62a_100010080479_200025704644 [0,2,0,0,0,0|1,0,0]=3 2854 B14R2.1128 Cc1cc2nccnc2cc1S[13CH3] 62a_200025704644_100010080479 [0,2,0,0,0,0|1,0,0]=3 2855 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 34a_200000079175_200025704644 [0,2,0,0,0,0|2,0,0]=4 2856 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 7a_200000079175_200025704644 [0,2,0,0,0,0|2,0,0]=4 2857 B14R2.1128 Cc1nc2nccnc2cc1S[13CH3] 62a_100010212747_200025704644 [0,2,0,0,0,0|2,0,0]=4 2858 B14R2.1128 Cc1nc2nccnc2cc1S[13CH3] 62a_200025704644_100010212747 [0,2,0,0,0,0|2,0,0]=4 2859 B14R2.1128 OCc1cc2ccccc2nc1O 271570a_203496583355_100000754719 [0,2,0,0,0,0|2,0,0]=4 2860 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 34a_100009991566_200025704644 [0,2,0,0,0,0|1,0,0]=3 2861 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 7a_100009991566_200025704644 [0,2,0,0,0,0|1,0,0]=3 2862 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 34a_100009817189_200025704644 [0,2,0,0,0,0|1,0,0]=3 2863 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 7a_100009817189_200025704644 [0,2,0,0,0,0|1,0,0]=3 2864 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 34a_106744474703_200025704644 [0,2,0,0,0,0|1,0,0]=3 2865 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 7a_106744474703_200025704644 [0,2,0,0,0,0|1,0,0]=3 2866 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 34a_200000100762_200025704644 [0,2,0,0,0,0|2,0,0]=4 2867 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 7a_200000100762_200025704644 [0,2,0,0,0,0|2,0,0]=4 2868 B14R2.1128 [13CH3]Oc1cc2ccccc2oc1=O 7a_100000061252_200025704644 [0,2,0,0,0,0|2,0,0]=4 2869 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 34a_200010153759_200025704644 [0,2,0,0,0,0|0,0,0]=2 2870 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 7a_200010153759_200025704644 [0,2,0,0,0,0|0,0,0]=2 2871 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200010169544_200025704644 [0,2,0,0,0,0|1,0,0]=3 2872 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200025704644_200010169544 [0,2,0,0,0,0|1,0,0]=3 2873 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_100010152806_200025704644 [0,2,0,0,0,0|1,0,0]=3 2874 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_200025704644_100010152806 [0,2,0,0,0,0|1,0,0]=3 2875 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_100009991566_200025704644 [0,2,0,0,0,0|1,0,0]=3 2876 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_200025704644_100009991566 [0,2,0,0,0,0|1,0,0]=3 2877 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1O 62a_200025704644_100009817189 [0,2,0,0,0,0|1,0,0]=3 2878 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1Cl 62a_200025704644_100010220712 [0,2,0,0,0,0|2,0,0]=4 2879 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_100011158909_200025704644 [0,2,0,0,0,0|2,0,0]=4 2880 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_200025704644_100011158909 [0,2,0,0,0,0|2,0,0]=4 2881 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1N 62a_100010135404_200025704644 [0,2,0,0,0,0|2,0,0]=4 2882 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1O 62a_200025704644_200009820883 [0,2,0,0,0,0|2,0,0]=4 2883 B14R2.1128 [13CH3]Sc1cc2ccccc2oc1=O 62a_200025704644_200000187772 [0,2,0,0,0,0|2,0,0]=4 2884 B14R2.1128 [13CH3]Sc1cc2cccnc2cc1F 62a_100009854028_200025704644 [0,2,0,0,0,0|0,0,0]=2 2885 B14R2.1128 [13CH3]Sc1cc2cccnc2cc1F 62a_200025704644_100009854028 [0,2,0,0,0,0|0,0,0]=2 2886 B14R2.1128 [13CH3]Sc1cc2ccncc2cc1F 62a_100011105921_200025704644 [0,2,0,0,0,0|2,0,0]=4 2887 B14R2.1128 [13CH3]Sc1cc2ccncc2cc1F 62a_200025704644_100011105921 [0,2,0,0,0,0|2,0,0]=4 2888 B14R2.1128 [13CH3]Sc1cc2cnccc2cc1F 62a_100010244713_200025704644 [0,2,0,0,0,0|2,0,0]=4 2889 B14R2.1128 [13CH3]Sc1cc2cnccc2cc1F 62a_200025704644_100010244713 [0,2,0,0,0,0|2,0,0]=4 2890 B14R2.1128 [13CH3]Sc1cc2ncccc2cc1O 62a_200025704644_200010153759 [0,2,0,0,0,0|1,0,0]=3 2891 B14R2.1128 [13CH3]Sc1cc2nccnc2cc1F 62a_100010080477_200025704644 [0,2,0,0,0,0|1,0,0]=3 2892 B14R2.1128 [13CH3]Sc1cc2nccnc2cc1F 62a_200025704644_100010080477 [0,2,0,0,0,0|1,0,0]=3 2893 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_100010072790_200025704644 [0,2,0,0,0,0|2,0,0]=4 2894 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_200025704644_100010072790 [0,2,0,0,0,0|2,0,0]=4 2895 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1O 62a_200025704644_200000100762 [0,2,0,0,0,0|2,0,0]=4 2896 B14R2.1801 C=Cc1ccc2c(cccc2c1)N 271570a_100011290941_100010090037 [0,2,0,0,0,0|1,0,1]=4 2897 B14R2.1801 C=Cc1ccc2c(cccc2c1)O 271570a_100011290941_100010202202 [0,2,0,0,0,0|1,0,1]=4 2898 B14R2.1801 CNc1ccc2c(cccc2c1)O 34a_100000035793_200000210301 [0,2,0,0,0,0|1,0,0]=3 2899 B14R2.1801 CNc1ccc2c(cccc2c1)O 7a_100000035793_200000210301 [0,2,0,0,0,0|1,0,0]=3 2900 B14R2.1801 CNc1ccc2c(ccnc2c1)Cl 27a_100102657272_100009996786 [0,2,0,0,0,0|2,0,0]=4 2901 B14R2.1801 COc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200000210301 [0,2,0,0,0,0|2,0,0]=4 2902 B14R2.1801 COc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200000210301 [0,2,0,0,0,0|2,0,0]=4 2903 B14R2.1801 COc1ccc2c(=O)ccoc2c1 34a_200000065989_200000210301 [0,2,0,0,0,0|2,0,0]=4 2904 B14R2.1801 COc1ccc2c(=O)ccoc2c1 7a_200000065989_200000210301 [0,2,0,0,0,0|2,0,0]=4 2905 B14R2.1801 COc1ccc2c(cccc2c1)N 34a_100000034668_200000210301 [0,2,0,0,0,0|1,0,0]=3 2906 B14R2.1801 COc1ccc2c(cccc2c1)N 7a_100000034668_200000210301 [0,2,0,0,0,0|1,0,0]=3 2907 B14R2.1801 COc1ccc2c(cccc2c1)O 271570a_203496583355_100010151670 [0,2,0,0,0,0|1,0,0]=3 2908 B14R2.1801 COc1ccc2c(ccnc2c1)Br 34a_100010204257_200000210301 [0,2,0,0,0,0|2,0,0]=4 2909 B14R2.1801 COc1ccc2c(ccnc2c1)Br 7a_100010204257_200000210301 [0,2,0,0,0,0|2,0,0]=4 2910 B14R2.1801 COc1ccc2c(ccnc2c1)C 34a_200009854145_200000210301 [0,2,0,0,0,0|2,0,0]=4 2911 B14R2.1801 COc1ccc2c(ccnc2c1)C 7a_200009854145_200000210301 [0,2,0,0,0,0|2,0,0]=4 2912 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 34a_100000045489_200000210301 [0,2,0,0,0,0|2,0,0]=4 2913 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 7a_100000045489_200000210301 [0,2,0,0,0,0|2,0,0]=4 2914 B14R2.1801 COc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045488 [0,2,0,0,0,0|2,0,0]=4 2915 B14R2.1801 COc1ccc2c(nccc2c1)Cl 34a_100009867704_200000210301 [0,2,0,0,0,0|2,0,0]=4 2916 B14R2.1801 COc1ccc2c(nccc2c1)Cl 7a_100009867704_200000210301 [0,2,0,0,0,0|2,0,0]=4 2917 B14R2.1801 COc1ccc2c(nccc2c1)O 271570a_203496583355_100000084302 [0,2,0,0,0,0|2,0,0]=4 2918 B14R2.1801 COc1cnc2c(cccc2c1)F 34a_100012184956_200000210301 [0,2,0,0,0,0|2,0,0]=4 2919 B14R2.1801 COc1cnc2c(cccc2c1)F 7a_100012184956_200000210301 [0,2,0,0,0,0|2,0,0]=4 2920 B14R2.1801 CSc1ccc2c(=O)ccoc2c1 62a_200000210301_100010062221 [0,2,0,0,0,0|2,0,0]=4 2921 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_100010090037_200000210301 [0,2,0,0,0,0|1,0,0]=3 2922 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_200000210301_100010090037 [0,2,0,0,0,0|1,0,0]=3 2923 B14R2.1801 CSc1ccc2c(cccc2c1)O 62a_200000210301_100010202202 [0,2,0,0,0,0|1,0,0]=3 2924 B14R2.1801 CSc1ccc2c(ccnc2c1)C 62a_100010132309_200000210301 [0,2,0,0,0,0|2,0,0]=4 2925 B14R2.1801 CSc1ccc2c(ccnc2c1)C 62a_200000210301_100010132309 [0,2,0,0,0,0|2,0,0]=4 2926 B14R2.1801 CSc1ccc2c(ccnc2c1)Cl 62a_100009996786_200000210301 [0,2,0,0,0,0|2,0,0]=4 2927 B14R2.1801 CSc1ccc2c(ccnc2c1)Cl 62a_200000210301_100009996786 [0,2,0,0,0,0|2,0,0]=4 2928 B14R2.1801 CSc1ccc2c(ccnc2c1)N 62a_200009816820_200000210301 [0,2,0,0,0,0|2,0,0]=4 2929 B14R2.1801 CSc1ccc2c(ccnc2c1)O 62a_200000210301_100000756855 [0,2,0,0,0,0|2,0,0]=4 2930 B14R2.1801 CSc1ccc2c(nccc2c1)N 62a_100000732483_200000210301 [0,2,0,0,0,0|2,0,0]=4 2931 B14R2.1801 CSc1ccc2c(nccc2c1)N 62a_200000210301_100000732483 [0,2,0,0,0,0|2,0,0]=4 2932 B14R2.1801 CSc1ccc2c(nccc2c1)O 62a_200000210301_100000760485 [0,2,0,0,0,0|2,0,0]=4 2933 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_100010204298_200000210301 [0,2,0,0,0,0|2,0,0]=4 2934 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_200000210301_100010204298 [0,2,0,0,0,0|2,0,0]=4 2935 B14R2.1801 CSc1cnc2c(cccc2c1)C 62a_200000210301_100009829671 [0,2,0,0,0,0|2,0,0]=4 2936 B14R2.1801 CSc1cnc2c(cccc2c1)Cl 62a_200000210301_100000759377 [0,2,0,0,0,0|2,0,0]=4 2937 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_100000049890_200000210301 [0,2,0,0,0,0|2,0,0]=4 2938 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_200000210301_100000049890 [0,2,0,0,0,0|2,0,0]=4 2939 B14R2.1801 CSc1cnc2c(cccc2c1)N 62a_200000210301_100000702407 [0,2,0,0,0,0|2,0,0]=4 2940 B14R2.1801 Cc1cccc2c1ncc(c2)S[13CH3] 62a_200025704644_100009829671 [0,2,0,0,0,0|2,0,0]=4 2941 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 34a_200009854145_200025704644 [0,2,0,0,0,0|2,0,0]=4 2942 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 7a_200009854145_200025704644 [0,2,0,0,0,0|2,0,0]=4 2943 B14R2.1801 Cc1ccnc2c1ccc(c2)S[13CH3] 62a_100010132309_200025704644 [0,2,0,0,0,0|2,0,0]=4 2944 B14R2.1801 Cc1ccnc2c1ccc(c2)S[13CH3] 62a_200025704644_100010132309 [0,2,0,0,0,0|2,0,0]=4 2945 B14R2.1801 N#Cc1ccc2c(cccc2c1)O 271570a_203496583355_100010090035 [0,2,0,0,0,0|1,0,1]=4 2946 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 34a_100000035793_200025704644 [0,2,0,0,0,0|1,0,0]=3 2947 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 7a_100000035793_200025704644 [0,2,0,0,0,0|1,0,0]=3 2948 B14R2.1801 [13CH3]Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200025704644 [0,2,0,0,0,0|2,0,0]=4 2949 B14R2.1801 [13CH3]Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200025704644 [0,2,0,0,0,0|2,0,0]=4 2950 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 34a_200000065989_200025704644 [0,2,0,0,0,0|2,0,0]=4 2951 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 7a_200000065989_200025704644 [0,2,0,0,0,0|2,0,0]=4 2952 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 34a_100000034668_200025704644 [0,2,0,0,0,0|1,0,0]=3 2953 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 7a_100000034668_200025704644 [0,2,0,0,0,0|1,0,0]=3 2954 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 34a_100010204257_200025704644 [0,2,0,0,0,0|2,0,0]=4 2955 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 7a_100010204257_200025704644 [0,2,0,0,0,0|2,0,0]=4 2956 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 34a_100000045489_200025704644 [0,2,0,0,0,0|2,0,0]=4 2957 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 7a_100000045489_200025704644 [0,2,0,0,0,0|2,0,0]=4 2958 B14R2.1801 [13CH3]Oc1ccc2c(nccc2c1)Cl 34a_100009867704_200025704644 [0,2,0,0,0,0|2,0,0]=4 2959 B14R2.1801 [13CH3]Oc1ccc2c(nccc2c1)Cl 7a_100009867704_200025704644 [0,2,0,0,0,0|2,0,0]=4 2960 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 34a_100012184956_200025704644 [0,2,0,0,0,0|2,0,0]=4 2961 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 7a_100012184956_200025704644 [0,2,0,0,0,0|2,0,0]=4 2962 B14R2.1801 [13CH3]Sc1ccc2c(=O)ccoc2c1 62a_200025704644_100010062221 [0,2,0,0,0,0|2,0,0]=4 2963 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_100010090037_200025704644 [0,2,0,0,0,0|1,0,0]=3 2964 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_200025704644_100010090037 [0,2,0,0,0,0|1,0,0]=3 2965 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)O 62a_200025704644_100010202202 [0,2,0,0,0,0|1,0,0]=3 2966 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)Cl 62a_100009996786_200025704644 [0,2,0,0,0,0|2,0,0]=4 2967 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)Cl 62a_200025704644_100009996786 [0,2,0,0,0,0|2,0,0]=4 2968 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)N 62a_200009816820_200025704644 [0,2,0,0,0,0|2,0,0]=4 2969 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)O 62a_200025704644_100000756855 [0,2,0,0,0,0|2,0,0]=4 2970 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)N 62a_100000732483_200025704644 [0,2,0,0,0,0|2,0,0]=4 2971 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)N 62a_200025704644_100000732483 [0,2,0,0,0,0|2,0,0]=4 2972 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)O 62a_200025704644_100000760485 [0,2,0,0,0,0|2,0,0]=4 2973 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_100010204298_200025704644 [0,2,0,0,0,0|2,0,0]=4 2974 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_200025704644_100010204298 [0,2,0,0,0,0|2,0,0]=4 2975 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Cl 62a_200025704644_100000759377 [0,2,0,0,0,0|2,0,0]=4 2976 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_100000049890_200025704644 [0,2,0,0,0,0|2,0,0]=4 2977 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_200025704644_100000049890 [0,2,0,0,0,0|2,0,0]=4 2978 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)N 62a_200025704644_100000702407 [0,2,0,0,0,0|2,0,0]=4 2979 B14R2.2332 C=Cc1ccc2[nH]c(=O)ccc2c1 271570a_100011290941_100011934725 [0,2,0,0,0,0|0,0,2]=4 2980 B14R2.2332 C=Cc1ccc2c[n+](ccc2c1)C 271570a_100011290941_100015191232 [0,2,0,0,0,0|2,0,0]=4 2981 B14R2.2332 C=Cc1ccc2cc(ccc2c1)Br 271570a_100011290941_100012344972 [0,2,0,0,0,0|1,0,1]=4 2982 B14R2.2332 C=Cc1ccc2cc(ccc2c1)F 271570a_100011290941_100009817052 [0,2,0,0,0,0|1,0,1]=4 2983 B14R2.2332 C=Cc1ccc2cc(ccc2c1)N 271570a_100011290941_100000185457 [0,2,0,0,0,0|1,0,1]=4 2984 B14R2.2332 C=Cc1ccc2cc(ccc2c1)O 271570a_100011290941_100000185455 [0,2,0,0,0,0|1,0,1]=4 2985 B14R2.2332 C=Cc1ccc2cc(ccc2n1)C 271570a_100011290941_100011865911 [0,2,0,0,0,0|0,0,0]=2 2986 B14R2.2332 C=Cc1ccc2cc(ccc2n1)F 271570a_100011290941_100011998705 [0,2,0,0,0,0|1,0,0]=3 2987 B14R2.2332 C=Cc1ccc2cc(ccc2n1)O 271570a_100011290941_100009849208 [0,2,0,0,0,0|1,0,0]=3 2988 B14R2.2332 C=Cc1ccc2cc(cnc2c1)C 271570a_100011290941_100010751441 [0,2,0,0,0,0|2,0,0]=4 2989 B14R2.2332 C=Cc1ccc2nc(ccc2c1)C 271570a_100011290941_100000686635 [0,2,0,0,0,0|0,0,1]=3 2990 B14R2.2332 C=Cc1ccc2nc(ccc2c1)Cl 271570a_100011290941_200012034268 [0,2,0,0,0,0|0,0,1]=3 2991 B14R2.2332 C=Cc1ccc2nc(ccc2c1)N 271570a_100011290941_100011934619 [0,2,0,0,0,0|0,0,1]=3 2992 B14R2.2332 C=Cc1ccc2nc(ccc2n1)C 271570a_100011290941_200009884078 [0,2,0,0,0,0|1,0,0]=3 2993 B14R2.2332 C=Cc1ccc2nc(ncc2c1)N 271570a_100011290941_100010138702 [0,2,0,0,0,0|1,0,1]=4 2994 B14R2.2332 C=Cc1ccc2oc(=O)ccc2c1 271570a_100011290941_100009999946 [0,2,0,0,0,0|1,0,1]=4 2995 B14R2.2332 C=Cc1cnc2cc(ccc2n1)F 271570a_100011290941_100000098432 [0,2,0,0,0,0|2,0,0]=4 2996 B14R2.2332 C=Cc1cnc2cc(ccc2n1)N 271570a_100011290941_100009885871 [0,2,0,0,0,0|2,0,0]=4 2997 B14R2.2332 C=Cc1cnc2cc(ccc2n1)O 271570a_100011290941_200010664160 [0,2,0,0,0,0|2,0,0]=4 2998 B14R2.2332 C=Cc1cnc2nc(ccc2c1)N 271570a_100011290941_100010214896 [0,2,0,0,0,0|1,0,1]=4 2999 B14R2.2332 C=Cc1cnc2nc(ccc2c1)O 271570a_100011290941_100009814606 [0,2,0,0,0,0|1,0,1]=4 3000 B14R2.2332 CNc1ccc2cc(ccc2c1)Br 34a_100000185457_200000210301 [0,2,0,0,0,0|1,0,0]=3 3001 B14R2.2332 CNc1ccc2cc(ccc2c1)Br 7a_100000185457_200000210301 [0,2,0,0,0,0|1,0,0]=3 3002 B14R2.2332 CNc1ccc2cc(ccc2n1)C 27a_100102657272_100011865911 [0,2,0,0,0,0|0,0,0]=2 3003 B14R2.2332 CNc1ccc2cc(ccc2n1)F 27a_100102657272_100011998705 [0,2,0,0,0,0|1,0,0]=3 3004 B14R2.2332 CNc1ccc2cc(ccc2n1)O 271570a_203496583355_200012034361 [0,2,0,0,0,0|1,0,0]=3 3005 B14R2.2332 CNc1ccc2cc(cnc2c1)Br 27a_100102657272_200015509644 [0,2,0,0,0,0|2,0,0]=4 3006 B14R2.2332 CNc1ccc2cc(cnc2c1)Br 34a_200010264087_200000210301 [0,2,0,0,0,0|2,0,0]=4 3007 B14R2.2332 CNc1ccc2nc(ccc2c1)C 34a_100011216442_200000210301 [0,2,0,0,0,0|0,0,0]=2 3008 B14R2.2332 CNc1ccc2nc(ccc2n1)C 27a_100102657272_200009884078 [0,2,0,0,0,0|1,0,0]=3 3009 B14R2.2332 CNc1ccc2nc(cnc2c1)Cl 34a_100009885871_200000210301 [0,2,0,0,0,0|1,0,0]=3 3010 B14R2.2332 CNc1ccc2oc(=O)ccc2c1 7a_100000008519_200000210301 [0,2,0,0,0,0|1,0,0]=3 3011 B14R2.2332 CNc1cnc2cc(ccc2n1)F 27a_100102657272_100000098432 [0,2,0,0,0,0|2,0,0]=4 3012 B14R2.2332 CNc1cnc2cc(ccc2n1)N 27a_100102657272_100009885871 [0,2,0,0,0,0|2,0,0]=4 3013 B14R2.2332 CNc1cnc2cc(ccc2n1)O 27a_100102657272_200010664160 [0,2,0,0,0,0|2,0,0]=4 3014 B14R2.2332 COc1ccc2cc(ccc2c1)Br 34a_100000185455_200000210301 [0,2,0,0,0,0|1,0,0]=3 3015 B14R2.2332 COc1ccc2cc(ccc2c1)Br 7a_100000185455_200000210301 [0,2,0,0,0,0|1,0,0]=3 3016 B14R2.2332 COc1ccc2cc(ccc2c1)C 34a_100000074090_200000210301 [0,2,0,0,0,0|1,0,0]=3 3017 B14R2.2332 COc1ccc2cc(ccc2c1)C 7a_100000074090_200000210301 [0,2,0,0,0,0|1,0,0]=3 3018 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 34a_100000074905_200000210301 [0,2,0,0,0,0|1,0,0]=3 3019 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 7a_100000074905_200000210301 [0,2,0,0,0,0|1,0,0]=3 3020 B14R2.2332 COc1ccc2cc(ccc2c1)F 34a_100009847029_200000210301 [0,2,0,0,0,0|1,0,0]=3 3021 B14R2.2332 COc1ccc2cc(ccc2c1)F 7a_100009847029_200000210301 [0,2,0,0,0,0|1,0,0]=3 3022 B14R2.2332 COc1ccc2cc(ccc2c1)O 271570a_203496583355_100000170439 [0,2,0,0,0,0|1,0,0]=3 3023 B14R2.2332 COc1ccc2cc(ccc2n1)O 271570a_203496583355_100009817092 [0,2,0,0,0,0|1,0,0]=3 3024 B14R2.2332 COc1ccc2cc(cnc2c1)Br 34a_200010153753_200000210301 [0,2,0,0,0,0|2,0,0]=4 3025 B14R2.2332 COc1ccc2cc(cnc2c1)Br 7a_200010153753_200000210301 [0,2,0,0,0,0|2,0,0]=4 3026 B14R2.2332 COc1ccc2nc(ccc2c1)C 34a_100000037634_200000210301 [0,2,0,0,0,0|0,0,0]=2 3027 B14R2.2332 COc1ccc2nc(ccc2c1)C 7a_100000037634_200000210301 [0,2,0,0,0,0|0,0,0]=2 3028 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 34a_100009849208_200000210301 [0,2,0,0,0,0|0,0,0]=2 3029 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 7a_100009849208_200000210301 [0,2,0,0,0,0|0,0,0]=2 3030 B14R2.2332 COc1ccc2nc(ccc2c1)O 271570a_203496583355_100000743015 [0,2,0,0,0,0|0,0,0]=2 3031 B14R2.2332 COc1ccc2nc(cnc2c1)Cl 34a_200010664160_200000210301 [0,2,0,0,0,0|1,0,0]=3 3032 B14R2.2332 COc1ccc2nc(cnc2c1)O 271570a_203496583355_100009843035 [0,2,0,0,0,0|1,0,0]=3 3033 B14R2.2332 COc1ccc2oc(=O)ccc2c1 34a_100000066265_200000210301 [0,2,0,0,0,0|1,0,0]=3 3034 B14R2.2332 COc1ccc2oc(=O)ccc2c1 7a_100000066265_200000210301 [0,2,0,0,0,0|1,0,0]=3 3035 B14R2.2332 COc1cnc2cc(ccc2c1)F 34a_100012184162_200000210301 [0,2,0,0,0,0|2,0,0]=4 3036 B14R2.2332 COc1cnc2cc(ccc2c1)F 7a_100012184162_200000210301 [0,2,0,0,0,0|2,0,0]=4 3037 B14R2.2332 CSc1ccc2[nH]c(=O)ccc2c1 62a_200000210301_100011934725 [0,2,0,0,0,0|0,0,1]=3 3038 B14R2.2332 CSc1ccc2[nH]c(=O)cnc2c1 62a_200000210301_100010209493 [0,2,0,0,0,0|1,0,1]=4 3039 B14R2.2332 CSc1ccc2c[n+](ccc2c1)C 62a_200000210301_100015191232 [0,2,0,0,0,0|2,0,0]=4 3040 B14R2.2332 CSc1ccc2cc(ccc2c1)Br 62a_100012344972_200000210301 [0,2,0,0,0,0|1,0,0]=3 3041 B14R2.2332 CSc1ccc2cc(ccc2c1)Br 62a_200000210301_100012344972 [0,2,0,0,0,0|1,0,0]=3 3042 B14R2.2332 CSc1ccc2cc(ccc2c1)F 62a_100009817052_200000210301 [0,2,0,0,0,0|1,0,0]=3 3043 B14R2.2332 CSc1ccc2cc(ccc2c1)F 62a_200000210301_100009817052 [0,2,0,0,0,0|1,0,0]=3 3044 B14R2.2332 CSc1ccc2cc(ccc2c1)N 62a_100000185457_200000210301 [0,2,0,0,0,0|1,0,0]=3 3045 B14R2.2332 CSc1ccc2cc(ccc2c1)N 62a_200000210301_100000185457 [0,2,0,0,0,0|1,0,0]=3 3046 B14R2.2332 CSc1ccc2cc(ccc2c1)O 62a_200000210301_100000185455 [0,2,0,0,0,0|1,0,0]=3 3047 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000181977_200000210301 [0,2,0,0,0,0|0,0,0]=2 3048 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000210301_100011865911 [0,2,0,0,0,0|0,0,0]=2 3049 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200000210301_100011998705 [0,2,0,0,0,0|1,0,0]=3 3050 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200012355665_200000210301 [0,2,0,0,0,0|1,0,0]=3 3051 B14R2.2332 CSc1ccc2cc(ccc2n1)O 62a_200000210301_100009849208 [0,2,0,0,0,0|1,0,0]=3 3052 B14R2.2332 CSc1ccc2cc(cnc2c1)Br 62a_200000210301_200015509644 [0,2,0,0,0,0|2,0,0]=4 3053 B14R2.2332 CSc1ccc2cc(cnc2c1)Br 62a_200015509644_200000210301 [0,2,0,0,0,0|2,0,0]=4 3054 B14R2.2332 CSc1ccc2cc(cnc2c1)C 62a_200000210301_100010751441 [0,2,0,0,0,0|2,0,0]=4 3055 B14R2.2332 CSc1ccc2cc(cnc2c1)F 62a_100010751466_200000210301 [0,2,0,0,0,0|2,0,0]=4 3056 B14R2.2332 CSc1ccc2cc(cnc2c1)F 62a_200000210301_100010751466 [0,2,0,0,0,0|2,0,0]=4 3057 B14R2.2332 CSc1ccc2cc(cnc2c1)N 62a_100010142226_200000210301 [0,2,0,0,0,0|2,0,0]=4 3058 B14R2.2332 CSc1ccc2cc(cnc2c1)N 62a_200000210301_100010142226 [0,2,0,0,0,0|2,0,0]=4 3059 B14R2.2332 CSc1ccc2cc(ncc2c1)N 62a_100010232990_200000210301 [0,2,0,0,0,0|2,0,0]=4 3060 B14R2.2332 CSc1ccc2cc(ncc2c1)N 62a_200000210301_100010232990 [0,2,0,0,0,0|2,0,0]=4 3061 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_100000686635_200000210301 [0,2,0,0,0,0|0,0,0]=2 3062 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_200000210301_100000686635 [0,2,0,0,0,0|0,0,0]=2 3063 B14R2.2332 CSc1ccc2nc(ccc2c1)Cl 62a_200000210301_200012034268 [0,2,0,0,0,0|0,0,0]=2 3064 B14R2.2332 CSc1ccc2nc(ccc2c1)N 62a_100011934619_200000210301 [0,2,0,0,0,0|0,0,0]=2 3065 B14R2.2332 CSc1ccc2nc(ccc2n1)C 62a_200000210301_200009884078 [0,2,0,0,0,0|1,0,0]=3 3066 B14R2.2332 CSc1ccc2nc(ncc2c1)N 62a_100010138702_200000210301 [0,2,0,0,0,0|1,0,0]=3 3067 B14R2.2332 CSc1ccc2nc(ncc2c1)N 62a_200000210301_100010138702 [0,2,0,0,0,0|1,0,0]=3 3068 B14R2.2332 CSc1ccc2oc(=O)ccc2c1 62a_200000210301_100009999946 [0,2,0,0,0,0|1,0,0]=3 3069 B14R2.2332 CSc1cnc2cc(ccc2c1)Cl 62a_100015716233_200000210301 [0,2,0,0,0,0|2,0,0]=4 3070 B14R2.2332 CSc1cnc2cc(ccc2c1)Cl 62a_200000210301_100015716233 [0,2,0,0,0,0|2,0,0]=4 3071 B14R2.2332 CSc1cnc2cc(ccc2c1)N 62a_200000210301_200010264087 [0,2,0,0,0,0|2,0,0]=4 3072 B14R2.2332 CSc1cnc2cc(ccc2c1)N 62a_200010264087_200000210301 [0,2,0,0,0,0|2,0,0]=4 3073 B14R2.2332 CSc1cnc2cc(ccc2c1)O 62a_200000210301_200010153753 [0,2,0,0,0,0|2,0,0]=4 3074 B14R2.2332 CSc1cnc2cc(ccc2n1)F 62a_100000098432_200000210301 [0,2,0,0,0,0|2,0,0]=4 3075 B14R2.2332 CSc1cnc2cc(ccc2n1)F 62a_200000210301_100000098432 [0,2,0,0,0,0|2,0,0]=4 3076 B14R2.2332 CSc1cnc2cc(ccc2n1)N 62a_200000210301_100009885871 [0,2,0,0,0,0|2,0,0]=4 3077 B14R2.2332 CSc1cnc2cc(ccc2n1)O 62a_200000210301_200010664160 [0,2,0,0,0,0|2,0,0]=4 3078 B14R2.2332 CSc1cnc2nc(ccc2c1)N 62a_100010214896_200000210301 [0,2,0,0,0,0|1,0,0]=3 3079 B14R2.2332 CSc1cnc2nc(ccc2c1)N 62a_200000210301_100010214896 [0,2,0,0,0,0|1,0,0]=3 3080 B14R2.2332 CSc1cnc2nc(ccc2c1)O 62a_200000210301_100009814606 [0,2,0,0,0,0|1,0,0]=3 3081 B14R2.2332 CSc1cnc2nc(ncc2c1)N 62a_200000210301_200010063650 [0,2,0,0,0,0|2,0,0]=4 3082 B14R2.2332 CSc1cnc2nc(ncc2c1)N 62a_200010063650_200000210301 [0,2,0,0,0,0|2,0,0]=4 3083 B14R2.2332 CSc1ncc2cc(ccc2n1)O 271570a_203496583355_100010240490 [0,2,0,0,0,0|2,0,0]=4 3084 B14R2.2332 C[n+]1ccc2cc(ccc2c1)S[13CH3] 62a_200025704644_100015191232 [0,2,0,0,0,0|2,0,0]=4 3085 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 34a_100000074090_200025704644 [0,2,0,0,0,0|1,0,0]=3 3086 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 7a_100000074090_200025704644 [0,2,0,0,0,0|1,0,0]=3 3087 B14R2.2332 Cc1ccc2cc(ccc2n1)N[13CH3] 34a_100011216442_200025704644 [0,2,0,0,0,0|0,0,0]=2 3088 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 34a_100000037634_200025704644 [0,2,0,0,0,0|0,0,0]=2 3089 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 7a_100000037634_200025704644 [0,2,0,0,0,0|0,0,0]=2 3090 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_100000686635_200025704644 [0,2,0,0,0,0|0,0,0]=2 3091 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_200025704644_100000686635 [0,2,0,0,0,0|0,0,0]=2 3092 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200000181977_200025704644 [0,2,0,0,0,0|0,0,0]=2 3093 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200025704644_100011865911 [0,2,0,0,0,0|0,0,0]=2 3094 B14R2.2332 Cc1ccc2nc(ccc2n1)S[13CH3] 62a_200025704644_200009884078 [0,2,0,0,0,0|1,0,0]=3 3095 B14R2.2332 Cc1cnc2cc(ccc2c1)S[13CH3] 62a_200025704644_100010751441 [0,2,0,0,0,0|2,0,0]=4 3096 B14R2.2332 N#Cc1ccc2cc(ccc2n1)O 271570a_203496583355_200012353941 [0,2,0,0,0,0|1,0,0]=3 3097 B14R2.2332 N#Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100000091635 [0,2,0,0,0,0|0,0,1]=3 3098 B14R2.2332 O=Cc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356508 [0,2,0,0,0,0|1,0,1]=4 3099 B14R2.2332 O=Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100000087602 [0,2,0,0,0,0|0,0,1]=3 3100 B14R2.2332 OCc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356509 [0,2,0,0,0,0|1,0,0]=3 3101 B14R2.2332 [13CH3]Nc1ccc2cc(ccc2c1)Br 34a_100000185457_200025704644 [0,2,0,0,0,0|1,0,0]=3 3102 B14R2.2332 [13CH3]Nc1ccc2cc(ccc2c1)Br 7a_100000185457_200025704644 [0,2,0,0,0,0|1,0,0]=3 3103 B14R2.2332 [13CH3]Nc1ccc2cc(cnc2c1)Br 34a_200010264087_200025704644 [0,2,0,0,0,0|2,0,0]=4 3104 B14R2.2332 [13CH3]Nc1ccc2nc(cnc2c1)Cl 34a_100009885871_200025704644 [0,2,0,0,0,0|1,0,0]=3 3105 B14R2.2332 [13CH3]Nc1ccc2oc(=O)ccc2c1 7a_100000008519_200025704644 [0,2,0,0,0,0|1,0,0]=3 3106 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 34a_100000185455_200025704644 [0,2,0,0,0,0|1,0,0]=3 3107 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 7a_100000185455_200025704644 [0,2,0,0,0,0|1,0,0]=3 3108 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_200025704644 [0,2,0,0,0,0|1,0,0]=3 3109 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_200025704644 [0,2,0,0,0,0|1,0,0]=3 3110 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 34a_100009847029_200025704644 [0,2,0,0,0,0|1,0,0]=3 3111 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 7a_100009847029_200025704644 [0,2,0,0,0,0|1,0,0]=3 3112 B14R2.2332 [13CH3]Oc1ccc2cc(cnc2c1)Br 34a_200010153753_200025704644 [0,2,0,0,0,0|2,0,0]=4 3113 B14R2.2332 [13CH3]Oc1ccc2cc(cnc2c1)Br 7a_200010153753_200025704644 [0,2,0,0,0,0|2,0,0]=4 3114 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 34a_100009849208_200025704644 [0,2,0,0,0,0|0,0,0]=2 3115 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 7a_100009849208_200025704644 [0,2,0,0,0,0|0,0,0]=2 3116 B14R2.2332 [13CH3]Oc1ccc2nc(cnc2c1)Cl 34a_200010664160_200025704644 [0,2,0,0,0,0|1,0,0]=3 3117 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 34a_100000066265_200025704644 [0,2,0,0,0,0|1,0,0]=3 3118 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 7a_100000066265_200025704644 [0,2,0,0,0,0|1,0,0]=3 3119 B14R2.2332 [13CH3]Oc1cnc2cc(ccc2c1)F 34a_100012184162_200025704644 [0,2,0,0,0,0|2,0,0]=4 3120 B14R2.2332 [13CH3]Oc1cnc2cc(ccc2c1)F 7a_100012184162_200025704644 [0,2,0,0,0,0|2,0,0]=4 3121 B14R2.2332 [13CH3]Sc1ccc2[nH]c(=O)ccc2c1 62a_200025704644_100011934725 [0,2,0,0,0,0|0,0,1]=3 3122 B14R2.2332 [13CH3]Sc1ccc2[nH]c(=O)cnc2c1 62a_200025704644_100010209493 [0,2,0,0,0,0|1,0,1]=4 3123 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)Br 62a_100012344972_200025704644 [0,2,0,0,0,0|1,0,0]=3 3124 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)Br 62a_200025704644_100012344972 [0,2,0,0,0,0|1,0,0]=3 3125 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)F 62a_100009817052_200025704644 [0,2,0,0,0,0|1,0,0]=3 3126 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)F 62a_200025704644_100009817052 [0,2,0,0,0,0|1,0,0]=3 3127 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)N 62a_100000185457_200025704644 [0,2,0,0,0,0|1,0,0]=3 3128 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)N 62a_200025704644_100000185457 [0,2,0,0,0,0|1,0,0]=3 3129 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)O 62a_200025704644_100000185455 [0,2,0,0,0,0|1,0,0]=3 3130 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200012355665_200025704644 [0,2,0,0,0,0|1,0,0]=3 3131 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200025704644_100011998705 [0,2,0,0,0,0|1,0,0]=3 3132 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)O 62a_200025704644_100009849208 [0,2,0,0,0,0|1,0,0]=3 3133 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)Br 62a_200015509644_200025704644 [0,2,0,0,0,0|2,0,0]=4 3134 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)Br 62a_200025704644_200015509644 [0,2,0,0,0,0|2,0,0]=4 3135 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)F 62a_100010751466_200025704644 [0,2,0,0,0,0|2,0,0]=4 3136 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)F 62a_200025704644_100010751466 [0,2,0,0,0,0|2,0,0]=4 3137 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)N 62a_100010142226_200025704644 [0,2,0,0,0,0|2,0,0]=4 3138 B14R2.2332 [13CH3]Sc1ccc2cc(cnc2c1)N 62a_200025704644_100010142226 [0,2,0,0,0,0|2,0,0]=4 3139 B14R2.2332 [13CH3]Sc1ccc2cc(ncc2c1)N 62a_100010232990_200025704644 [0,2,0,0,0,0|2,0,0]=4 3140 B14R2.2332 [13CH3]Sc1ccc2cc(ncc2c1)N 62a_200025704644_100010232990 [0,2,0,0,0,0|2,0,0]=4 3141 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)Cl 62a_200025704644_200012034268 [0,2,0,0,0,0|0,0,0]=2 3142 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)N 62a_100011934619_200025704644 [0,2,0,0,0,0|0,0,0]=2 3143 B14R2.2332 [13CH3]Sc1ccc2nc(ncc2c1)N 62a_100010138702_200025704644 [0,2,0,0,0,0|1,0,0]=3 3144 B14R2.2332 [13CH3]Sc1ccc2nc(ncc2c1)N 62a_200025704644_100010138702 [0,2,0,0,0,0|1,0,0]=3 3145 B14R2.2332 [13CH3]Sc1ccc2oc(=O)ccc2c1 62a_200025704644_100009999946 [0,2,0,0,0,0|1,0,0]=3 3146 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2c1)Cl 62a_100015716233_200025704644 [0,2,0,0,0,0|2,0,0]=4 3147 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2c1)Cl 62a_200025704644_100015716233 [0,2,0,0,0,0|2,0,0]=4 3148 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2c1)N 62a_200010264087_200025704644 [0,2,0,0,0,0|2,0,0]=4 3149 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2c1)N 62a_200025704644_200010264087 [0,2,0,0,0,0|2,0,0]=4 3150 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2c1)O 62a_200025704644_200010153753 [0,2,0,0,0,0|2,0,0]=4 3151 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2n1)F 62a_100000098432_200025704644 [0,2,0,0,0,0|2,0,0]=4 3152 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2n1)F 62a_200025704644_100000098432 [0,2,0,0,0,0|2,0,0]=4 3153 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2n1)N 62a_200025704644_100009885871 [0,2,0,0,0,0|2,0,0]=4 3154 B14R2.2332 [13CH3]Sc1cnc2cc(ccc2n1)O 62a_200025704644_200010664160 [0,2,0,0,0,0|2,0,0]=4 3155 B14R2.2332 [13CH3]Sc1cnc2nc(ccc2c1)N 62a_100010214896_200025704644 [0,2,0,0,0,0|1,0,0]=3 3156 B14R2.2332 [13CH3]Sc1cnc2nc(ccc2c1)N 62a_200025704644_100010214896 [0,2,0,0,0,0|1,0,0]=3 3157 B14R2.2332 [13CH3]Sc1cnc2nc(ccc2c1)O 62a_200025704644_100009814606 [0,2,0,0,0,0|1,0,0]=3 3158 B14R2.2332 [13CH3]Sc1cnc2nc(ncc2c1)N 62a_200010063650_200025704644 [0,2,0,0,0,0|2,0,0]=4 3159 B14R2.2332 [13CH3]Sc1cnc2nc(ncc2c1)N 62a_200025704644_200010063650 [0,2,0,0,0,0|2,0,0]=4 3160 B14R2.8239 Cc1cc2cc(ccc2nc1N)O 271570a_203496583355_100011830096 [0,2,0,0,0,0|1,0,0]=3 3161 B14R2.8239 Nc1cnc2cc(c(cc2c1)O)F 271570a_203496583355_100021278121 [0,2,0,0,0,0|1,0,0]=3 3162 B14R2.8239 Oc1ccc2cc(c(cc2c1)O)O 271570a_203496583355_100010179872 [0,2,0,0,0,0|2,0,0]=4 3163 B14R2.8239 Oc1cnc2cc(c(cc2n1)F)F 271570a_203496583355_100000754878 [0,2,0,0,0,0|2,0,0]=4 3164 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [0,2,0,0,0,0|2,0,0]=4 3165 B14R2.29365 Cc1cc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100010883700 [0,2,0,0,0,0|2,0,0]=4 3166 B14R2.29365 Nc1cc(c2ncc(cc2c1)O)F 271570a_203496583355_100010780968 [0,2,0,0,0,0|1,0,0]=3 3167 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [0,2,0,0,0,0|2,0,0]=4 3168 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [0,2,0,0,0,0|2,0,0]=4 3169 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [0,2,0,0,0,0|2,0,0]=4 3170 B14R2.8045 Cc1cc(c2nccc(c2c1)O)C 271570a_203496583355_100011310474 [0,2,0,0,0,0|0,0,0]=2 3171 B14R2.8045 O=c1cc[nH]c2c1cc(cc2F)O 271570a_203496583355_100000749450 [0,2,0,0,0,0|1,0,1]=4 3172 B14R2.8045 Oc1ccnc2c1cc(cc2F)F 271570a_203496583355_100000751274 [0,2,0,0,0,0|1,0,0]=3 3173 B14R2.8235 Cc1cc(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100009820897 [0,2,0,0,0,0|1,0,1]=4 3174 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011333642 [0,2,0,0,0,0|1,0,1]=4 3175 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O 271570a_203496583355_100000689691 [0,2,0,0,0,0|1,0,0]=3 3176 B14R2.8235 Cc1cc(c2cc(ccc2n1)O)N 271570a_203496583355_100000238323 [0,2,0,0,0,0|1,0,0]=3 3177 B14R2.8235 Cc1cc(c2nc(ccc2c1)O)C 271570a_203496583355_200012017542 [0,2,0,0,0,0|0,0,0]=2 3178 B14R2.8235 Cc1cc(nc2c1cc(cc2)F)O 271570a_203496583355_200000079853 [0,2,0,0,0,0|1,0,0]=3 3179 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [0,2,0,0,0,0|0,0,0]=2 3180 B14R2.8235 Cc1ccc2nc(nc(c2c1)O)C 271570a_203496583355_100013022803 [0,2,0,0,0,0|1,0,0]=3 3181 B14R2.8235 Cc1nc(c2cc(ccc2n1)F)O 271570a_203496583355_100012002098 [0,2,0,0,0,0|2,0,0]=4 3182 B14R2.8235 Cc1nc(c2nc(ccc2n1)O)N 271570a_203496583355_103550258228 [0,2,0,0,0,0|2,0,0]=4 3183 B14R2.8235 Cc1nc2ccc(cc2c(=O)[nH]1)O 271570a_203496583355_100000741707 [0,2,0,0,0,0|2,0,0]=4 3184 B14R2.8235 Cc1nc2ccc(cc2c(=O)o1)O 271570a_203496583355_200009814615 [0,2,0,0,0,0|2,0,0]=4 3185 B14R2.8235 Nc1nc2ccc(cc2c(=O)[nH]1)O 271570a_203496583355_100009815394 [0,2,0,0,0,0|2,0,0]=4 3186 B14R2.8235 O=c1cc(c2cc(ccc2[nH]1)O)O 271570a_203496583355_100000695641 [0,2,0,0,0,0|1,0,1]=4 3187 B14R2.8235 O=c1cc(c2cc(ccc2o1)O)O 271570a_203496583355_100009814091 [0,2,0,0,0,0|2,0,0]=4 3188 B14R2.8235 O=c1cc(nc2n1cc(cc2)F)O 271570a_203496583355_100015492560 [0,2,0,0,0,0|2,0,0]=4 3189 B14R2.8235 O=c1cc(nc2n1cc(cc2)O)O 271570a_203496583355_100016101194 [0,2,0,0,0,0|2,0,0]=4 3190 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)F)O 271570a_203496583355_100012034177 [0,2,0,0,0,0|1,0,1]=4 3191 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)Cl 271570a_203496583355_200014262637 [0,2,0,0,0,0|1,0,1]=4 3192 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)F 271570a_203496583355_200012639799 [0,2,0,0,0,0|1,0,1]=4 3193 B14R2.8235 Oc1cc(c2cc(ccc2c1)O)F 271570a_203496583355_100010201084 [0,2,0,0,0,0|2,0,0]=4 3194 B14R2.8751 Cc1ccc2c(ccc(c2n1)N)O 271570a_203496583355_100012970290 [0,2,0,0,0,0|2,0,0]=4 3195 B14R2.11684 C=Cc1cccc2c1cc(cc2)O 271570a_100011290941_100010169565 [0,2,0,0,0,0|2,0,0]=4 3196 B14R2.11684 C=Cc1cccc2c1nc(cc2)C 271570a_100011290941_100011934484 [0,2,0,0,0,0|2,0,0]=4 3197 B14R2.11684 C=Cc1ccnc2c1cc(cc2)Br 271570a_100011290941_100010189052 [0,2,0,0,0,0|1,0,0]=3 3198 B14R2.11684 C=Cc1ccnc2c1cc(cc2)C 271570a_100011290941_100000751279 [0,2,0,0,0,0|0,0,0]=2 3199 B14R2.11684 C=Cc1ccnc2c1cc(cc2)F 271570a_100011290941_100011217270 [0,2,0,0,0,0|1,0,0]=3 3200 B14R2.11684 C=Cc1ccnc2c1cc(cc2)N 271570a_100011290941_100009879071 [0,2,0,0,0,0|1,0,0]=3 3201 B14R2.11684 C=Cc1ccnc2c1cc(cc2)O 271570a_100011290941_100000075933 [0,2,0,0,0,0|1,0,0]=3 3202 B14R2.11684 C=Cc1ccnc2c1nc(cc2)C 271570a_100011290941_100009889967 [0,2,0,0,0,0|1,0,0]=3 3203 B14R2.11684 C=Cc1ccnc2c1nc(cc2)F 271570a_100011290941_100000719316 [0,2,0,0,0,0|2,0,0]=4 3204 B14R2.11684 C=Cc1cncc2c1cc(cc2)C 271570a_100011290941_100009817139 [0,2,0,0,0,0|2,0,0]=4 3205 B14R2.11684 C=Cc1ncnc2c1cc(cc2)C 271570a_100011290941_100000743341 [0,2,0,0,0,0|1,0,0]=3 3206 B14R2.11684 C=Cc1ncnc2c1cc(cc2)F 271570a_100011290941_100000743340 [0,2,0,0,0,0|2,0,0]=4 3207 B14R2.11684 CNc1cccc2c1cc(cc2)Br 34a_100010090012_200000210301 [0,2,0,0,0,0|2,0,0]=4 3208 B14R2.11684 CNc1cccc2c1cc(cc2)O 34a_100000034012_200000210301 [0,2,0,0,0,0|2,0,0]=4 3209 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [0,2,0,0,0,0|2,0,0]=4 3210 B14R2.11684 CNc1ccnc2c1cc(cc2)Br 27a_100102657272_100010189052 [0,2,0,0,0,0|1,0,0]=3 3211 B14R2.11684 CNc1ccnc2c1cc(cc2)C 27a_100102657272_100000751279 [0,2,0,0,0,0|0,0,0]=2 3212 B14R2.11684 CNc1ccnc2c1cc(cc2)F 27a_100102657272_100011217270 [0,2,0,0,0,0|1,0,0]=3 3213 B14R2.11684 CNc1ccnc2c1cc(cc2)N 27a_100102657272_100009879071 [0,2,0,0,0,0|1,0,0]=3 3214 B14R2.11684 CNc1ccnc2c1cc(cc2)O 271570a_203496583355_200011620572 [0,2,0,0,0,0|1,0,0]=3 3215 B14R2.11684 CNc1ccnc2c1nc(cc2)C 27a_100102657272_100009889967 [0,2,0,0,0,0|1,0,0]=3 3216 B14R2.11684 CNc1ccnc2c1nc(cc2)F 27a_100102657272_100000719316 [0,2,0,0,0,0|2,0,0]=4 3217 B14R2.11684 CNc1ncnc2c1cc(cc2)C 27a_100102657272_100000743341 [0,2,0,0,0,0|1,0,0]=3 3218 B14R2.11684 CNc1ncnc2c1cc(cc2)F 27a_100102657272_100000743340 [0,2,0,0,0,0|2,0,0]=4 3219 B14R2.11684 COc1cccc2c1cc(cc2)Br 34a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 3220 B14R2.11684 COc1cccc2c1cc(cc2)Br 7a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 3221 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [0,2,0,0,0,0|1,0,0]=3 3222 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [0,2,0,0,0,0|1,0,0]=3 3223 B14R2.11684 COc1cccc2c1cc(cc2)Cl 34a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 3224 B14R2.11684 COc1cccc2c1cc(cc2)Cl 7a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 3225 B14R2.11684 COc1cccc2c1cc(cc2)F 34a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 3226 B14R2.11684 COc1cccc2c1cc(cc2)F 7a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 3227 B14R2.11684 COc1cccc2c1cc(cc2)N 34a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 3228 B14R2.11684 COc1cccc2c1cc(cc2)N 7a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 3229 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [0,2,0,0,0,0|2,0,0]=4 3230 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [0,2,0,0,0,0|2,0,0]=4 3231 B14R2.11684 COc1ccnc2c1cc(cc2)C 34a_200011310529_200000210301 [0,2,0,0,0,0|0,0,0]=2 3232 B14R2.11684 COc1ccnc2c1cc(cc2)F 34a_100000004104_200000210301 [0,2,0,0,0,0|1,0,0]=3 3233 B14R2.11684 COc1ccnc2c1cc(cc2)O 271570a_203496583355_100009816692 [0,2,0,0,0,0|1,0,0]=3 3234 B14R2.11684 COc1ncnc2c1cc(cc2)O 271570a_203496583355_200009811869 [0,2,0,0,0,0|2,0,0]=4 3235 B14R2.11684 CSc1cccc2c1cc(cc2)O 62a_200000210301_100010169565 [0,2,0,0,0,0|2,0,0]=4 3236 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [0,2,0,0,0,0|2,0,0]=4 3237 B14R2.11684 CSc1ccnc2c1cc(cc2)Br 62a_100010189052_200000210301 [0,2,0,0,0,0|1,0,0]=3 3238 B14R2.11684 CSc1ccnc2c1cc(cc2)Br 62a_200000210301_100010189052 [0,2,0,0,0,0|1,0,0]=3 3239 B14R2.11684 CSc1ccnc2c1cc(cc2)C 62a_200000210301_100000751279 [0,2,0,0,0,0|0,0,0]=2 3240 B14R2.11684 CSc1ccnc2c1cc(cc2)F 62a_100011217270_200000210301 [0,2,0,0,0,0|1,0,0]=3 3241 B14R2.11684 CSc1ccnc2c1cc(cc2)F 62a_200000210301_100011217270 [0,2,0,0,0,0|1,0,0]=3 3242 B14R2.11684 CSc1ccnc2c1cc(cc2)N 62a_100010074812_200000210301 [0,2,0,0,0,0|1,0,0]=3 3243 B14R2.11684 CSc1ccnc2c1cc(cc2)N 62a_200000210301_100009879071 [0,2,0,0,0,0|1,0,0]=3 3244 B14R2.11684 CSc1ccnc2c1cc(cc2)O 62a_200000210301_100000075933 [0,2,0,0,0,0|1,0,0]=3 3245 B14R2.11684 CSc1ccnc2c1nc(cc2)C 62a_200000210301_100009889967 [0,2,0,0,0,0|1,0,0]=3 3246 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_100000719316_200000210301 [0,2,0,0,0,0|2,0,0]=4 3247 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_200000210301_100000719316 [0,2,0,0,0,0|2,0,0]=4 3248 B14R2.11684 CSc1cncc2c1cc(cc2)C 62a_200000210301_100009817139 [0,2,0,0,0,0|2,0,0]=4 3249 B14R2.11684 CSc1ncnc2c1cc(cc2)C 62a_200000210301_100000743341 [0,2,0,0,0,0|1,0,0]=3 3250 B14R2.11684 CSc1ncnc2c1cc(cc2)F 62a_200000210301_100000743340 [0,2,0,0,0,0|2,0,0]=4 3251 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [0,2,0,0,0,0|1,0,0]=3 3252 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [0,2,0,0,0,0|1,0,0]=3 3253 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [0,2,0,0,0,0|2,0,0]=4 3254 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [0,2,0,0,0,0|2,0,0]=4 3255 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [0,2,0,0,0,0|2,0,0]=4 3256 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [0,2,0,0,0,0|2,0,0]=4 3257 B14R2.11684 Cc1ccc2cncc(c2c1)S[13CH3] 62a_200025704644_100009817139 [0,2,0,0,0,0|2,0,0]=4 3258 B14R2.11684 Cc1ccc2nccc(c2c1)O[13CH3] 34a_200011310529_200025704644 [0,2,0,0,0,0|0,0,0]=2 3259 B14R2.11684 Cc1ccc2nccc(c2c1)S[13CH3] 62a_200025704644_100000751279 [0,2,0,0,0,0|0,0,0]=2 3260 B14R2.11684 Cc1ccc2nccc(c2n1)S[13CH3] 62a_200025704644_100009889967 [0,2,0,0,0,0|1,0,0]=3 3261 B14R2.11684 Cc1ccc2ncnc(c2c1)S[13CH3] 62a_200025704644_100000743341 [0,2,0,0,0,0|1,0,0]=3 3262 B14R2.11684 O=Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100010176920 [0,2,0,0,0,0|1,0,0]=3 3263 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)Br 34a_100010090012_200025704644 [0,2,0,0,0,0|2,0,0]=4 3264 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)O 34a_100000034012_200025704644 [0,2,0,0,0,0|2,0,0]=4 3265 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 34a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 3266 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 7a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 3267 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 34a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 3268 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 7a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 3269 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 34a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 3270 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 7a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 3271 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 34a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 3272 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 7a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 3273 B14R2.11684 [13CH3]Oc1ccnc2c1cc(cc2)F 34a_100000004104_200025704644 [0,2,0,0,0,0|1,0,0]=3 3274 B14R2.11684 [13CH3]Sc1cccc2c1cc(cc2)O 62a_200025704644_100010169565 [0,2,0,0,0,0|2,0,0]=4 3275 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)Br 62a_100010189052_200025704644 [0,2,0,0,0,0|1,0,0]=3 3276 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)Br 62a_200025704644_100010189052 [0,2,0,0,0,0|1,0,0]=3 3277 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)F 62a_100011217270_200025704644 [0,2,0,0,0,0|1,0,0]=3 3278 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)F 62a_200025704644_100011217270 [0,2,0,0,0,0|1,0,0]=3 3279 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)N 62a_100010074812_200025704644 [0,2,0,0,0,0|1,0,0]=3 3280 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)N 62a_200025704644_100009879071 [0,2,0,0,0,0|1,0,0]=3 3281 B14R2.11684 [13CH3]Sc1ccnc2c1cc(cc2)O 62a_200025704644_100000075933 [0,2,0,0,0,0|1,0,0]=3 3282 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_100000719316_200025704644 [0,2,0,0,0,0|2,0,0]=4 3283 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_200025704644_100000719316 [0,2,0,0,0,0|2,0,0]=4 3284 B14R2.11684 [13CH3]Sc1ncnc2c1cc(cc2)F 62a_200025704644_100000743340 [0,2,0,0,0,0|2,0,0]=4 3285 B14R2.28472 Oc1cc2c(ncnc2cc1F)O 271570a_203496583355_100000699150 [0,2,0,0,0,0|2,0,0]=4 3286 B14R2.28472 Oc1ncnc2c1cc(c(c2)F)F 271570a_203496583355_100000757567 [0,2,0,0,0,0|2,0,0]=4 3287 B14R2.1146 C=Cc1cc(cc2c1cccc2)N 271570a_100011290941_100010089974 [0,2,0,0,0,0|2,0,0]=4 3288 B14R2.1146 C=Cc1cc(cc2c1cccc2)O 271570a_100011290941_100010001680 [0,2,0,0,0,0|2,0,0]=4 3289 B14R2.1146 C=Cc1cc(cc2c1nccc2)Br 271570a_100011290941_100010090713 [0,2,0,0,0,0|1,0,0]=3 3290 B14R2.1146 C=Cc1cc(cc2c1nccc2)C 271570a_100011290941_100010113427 [0,2,0,0,0,0|0,0,0]=2 3291 B14R2.1146 C=Cc1cc(cc2c1nccc2)F 271570a_100011290941_100010214460 [0,2,0,0,0,0|1,0,0]=3 3292 B14R2.1146 C=Cc1cc(cc2c1nccn2)F 271570a_100011290941_100011083936 [0,2,0,0,0,0|2,0,0]=4 3293 B14R2.1146 C=Cc1cc(nc2c1cccc2)C 271570a_100011290941_100000764982 [0,2,0,0,0,0|2,0,0]=4 3294 B14R2.1146 C=Cc1nc(cc2c1cccc2)C 271570a_100011290941_100000698243 [0,2,0,0,0,0|2,0,0]=4 3295 B14R2.1146 C=Cc1nc(cc2c1nccc2)N 271570a_100011290941_100010205410 [0,2,0,0,0,0|2,0,0]=4 3296 B14R2.1146 CNc1cc(cc2c1cccc2)Br 34a_100010171453_200000210301 [0,2,0,0,0,0|2,0,0]=4 3297 B14R2.1146 CNc1cc(cc2c1nccc2)Br 27a_100102657272_100010090713 [0,2,0,0,0,0|1,0,0]=3 3298 B14R2.1146 CNc1cc(cc2c1nccc2)Br 34a_100009814519_200000210301 [0,2,0,0,0,0|1,0,0]=3 3299 B14R2.1146 CNc1cc(cc2c1nccc2)Cl 34a_100000026717_200000210301 [0,2,0,0,0,0|1,0,0]=3 3300 B14R2.1146 CNc1cc(cc2c1nccc2)F 27a_100102657272_100010214460 [0,2,0,0,0,0|1,0,0]=3 3301 B14R2.1146 CNc1cc(cc2c1nccc2)F 34a_100000088212_200000210301 [0,2,0,0,0,0|1,0,0]=3 3302 B14R2.1146 CNc1cc(cc2c1nccc2)O 34a_100000083691_200000210301 [0,2,0,0,0,0|1,0,0]=3 3303 B14R2.1146 CNc1cc(cc2c1nccn2)F 27a_100102657272_100011083936 [0,2,0,0,0,0|2,0,0]=4 3304 B14R2.1146 CNc1cc(nc2c1cccc2)C 27a_100102657272_100000735862 [0,2,0,0,0,0|2,0,0]=4 3305 B14R2.1146 CNc1nc(cc2c1cccc2)C 27a_100102657272_100000698243 [0,2,0,0,0,0|2,0,0]=4 3306 B14R2.1146 CNc1nc(cc2c1nccc2)N 27a_100102657272_100010205410 [0,2,0,0,0,0|2,0,0]=4 3307 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 3308 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 3309 B14R2.1146 COc1cc(cc2c1nccc2)Br 34a_100010248853_200000210301 [0,2,0,0,0,0|1,0,0]=3 3310 B14R2.1146 COc1cc(cc2c1nccc2)Br 7a_100010248853_200000210301 [0,2,0,0,0,0|1,0,0]=3 3311 B14R2.1146 COc1cc(cc2c1nccc2)C 34a_100009888445_200000210301 [0,2,0,0,0,0|0,0,0]=2 3312 B14R2.1146 COc1cc(cc2c1nccc2)C 7a_100009888445_200000210301 [0,2,0,0,0,0|0,0,0]=2 3313 B14R2.1146 COc1cc(cc2c1nccc2)Cl 34a_200000089624_200000210301 [0,2,0,0,0,0|1,0,0]=3 3314 B14R2.1146 COc1cc(cc2c1nccc2)Cl 7a_200000089624_200000210301 [0,2,0,0,0,0|1,0,0]=3 3315 B14R2.1146 COc1cc(cc2c1nccc2)O 271570a_203496583355_100010248852 [0,2,0,0,0,0|1,0,0]=3 3316 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [0,2,0,0,0,0|2,0,0]=4 3317 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 3318 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_200000210301_100010089974 [0,2,0,0,0,0|2,0,0]=4 3319 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [0,2,0,0,0,0|2,0,0]=4 3320 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_100010090713_200000210301 [0,2,0,0,0,0|1,0,0]=3 3321 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_200000210301_100010090713 [0,2,0,0,0,0|1,0,0]=3 3322 B14R2.1146 CSc1cc(cc2c1nccc2)C 62a_200000210301_100010113427 [0,2,0,0,0,0|0,0,0]=2 3323 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_100010214460_200000210301 [0,2,0,0,0,0|1,0,0]=3 3324 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_200000210301_100010214460 [0,2,0,0,0,0|1,0,0]=3 3325 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_100011083936_200000210301 [0,2,0,0,0,0|2,0,0]=4 3326 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_200000210301_100011083936 [0,2,0,0,0,0|2,0,0]=4 3327 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_100000764982_200000210301 [0,2,0,0,0,0|2,0,0]=4 3328 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_200000210301_100000735862 [0,2,0,0,0,0|2,0,0]=4 3329 B14R2.1146 CSc1nc(cc2c1cccc2)C 62a_200000210301_100000698243 [0,2,0,0,0,0|2,0,0]=4 3330 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_100010205410_200000210301 [0,2,0,0,0,0|2,0,0]=4 3331 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_200000210301_100010205410 [0,2,0,0,0,0|2,0,0]=4 3332 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [0,2,0,0,0,0|2,0,0]=4 3333 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_100000764982_200025704644 [0,2,0,0,0,0|2,0,0]=4 3334 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_200025704644_100000735862 [0,2,0,0,0,0|2,0,0]=4 3335 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 34a_100009888445_200025704644 [0,2,0,0,0,0|0,0,0]=2 3336 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 7a_100009888445_200025704644 [0,2,0,0,0,0|0,0,0]=2 3337 B14R2.1146 Cc1cc(c2ncccc2c1)S[13CH3] 62a_200025704644_100010113427 [0,2,0,0,0,0|0,0,0]=2 3338 B14R2.1146 Cc1cc2ccccc2c(n1)S[13CH3] 62a_200025704644_100000698243 [0,2,0,0,0,0|2,0,0]=4 3339 B14R2.1146 [13CH3]Nc1cc(cc2c1cccc2)Br 34a_100010171453_200025704644 [0,2,0,0,0,0|2,0,0]=4 3340 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Br 34a_100009814519_200025704644 [0,2,0,0,0,0|1,0,0]=3 3341 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200025704644 [0,2,0,0,0,0|1,0,0]=3 3342 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)F 34a_100000088212_200025704644 [0,2,0,0,0,0|1,0,0]=3 3343 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)O 34a_100000083691_200025704644 [0,2,0,0,0,0|1,0,0]=3 3344 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 3345 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 3346 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 34a_100010248853_200025704644 [0,2,0,0,0,0|1,0,0]=3 3347 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 7a_100010248853_200025704644 [0,2,0,0,0,0|1,0,0]=3 3348 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 34a_200000089624_200025704644 [0,2,0,0,0,0|1,0,0]=3 3349 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 7a_200000089624_200025704644 [0,2,0,0,0,0|1,0,0]=3 3350 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 3351 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_200025704644_100010089974 [0,2,0,0,0,0|2,0,0]=4 3352 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [0,2,0,0,0,0|2,0,0]=4 3353 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_100010090713_200025704644 [0,2,0,0,0,0|1,0,0]=3 3354 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_200025704644_100010090713 [0,2,0,0,0,0|1,0,0]=3 3355 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_100010214460_200025704644 [0,2,0,0,0,0|1,0,0]=3 3356 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_200025704644_100010214460 [0,2,0,0,0,0|1,0,0]=3 3357 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_100011083936_200025704644 [0,2,0,0,0,0|2,0,0]=4 3358 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_200025704644_100011083936 [0,2,0,0,0,0|2,0,0]=4 3359 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_100010205410_200025704644 [0,2,0,0,0,0|2,0,0]=4 3360 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_200025704644_100010205410 [0,2,0,0,0,0|2,0,0]=4 3361 B14R2.1073 C=Cc1cccc2c1ccc(n2)C 271570a_100011290941_100010173736 [0,2,0,0,0,0|2,0,0]=4 3362 B14R2.1073 C=Cc1nccc2c1ccc(c2)C 271570a_100011290941_100000102439 [0,2,0,0,0,0|2,0,0]=4 3363 B14R2.1073 CNc1cccc2c1ccc(c2)Br 34a_100010090037_200000210301 [0,2,0,0,0,0|2,0,0]=4 3364 B14R2.1073 CNc1cccc2c1ccc(c2)O 34a_100000034668_200000210301 [0,2,0,0,0,0|2,0,0]=4 3365 B14R2.1073 CNc1cccc2c1ccc(n2)C 27a_100102657272_100010173736 [0,2,0,0,0,0|2,0,0]=4 3366 B14R2.1073 CNc1cccc2c1ccc(n2)C 34a_106741707140_200000210301 [0,2,0,0,0,0|2,0,0]=4 3367 B14R2.1073 CNc1nccc2c1ccc(c2)C 27a_100102657272_100000102439 [0,2,0,0,0,0|2,0,0]=4 3368 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 3369 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 3370 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 3371 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 3372 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [0,2,0,0,0,0|2,0,0]=4 3373 B14R2.1073 COc1cccc2c1ncc(c2)C 34a_100000144662_200000210301 [0,2,0,0,0,0|2,0,0]=4 3374 B14R2.1073 COc1cccc2c1ncc(c2)C 7a_100000144662_200000210301 [0,2,0,0,0,0|2,0,0]=4 3375 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_100010173736_200000210301 [0,2,0,0,0,0|2,0,0]=4 3376 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_200000210301_100010173736 [0,2,0,0,0,0|2,0,0]=4 3377 B14R2.1073 CSc1nccc2c1ccc(c2)C 62a_200000210301_100000102439 [0,2,0,0,0,0|2,0,0]=4 3378 B14R2.1073 Cc1ccc2c(cccc2n1)N[13CH3] 34a_106741707140_200025704644 [0,2,0,0,0,0|2,0,0]=4 3379 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_100010173736_200025704644 [0,2,0,0,0,0|2,0,0]=4 3380 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_200025704644_100010173736 [0,2,0,0,0,0|2,0,0]=4 3381 B14R2.1073 Cc1ccc2c(nccc2c1)S[13CH3] 62a_200025704644_100000102439 [0,2,0,0,0,0|2,0,0]=4 3382 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 34a_100000144662_200025704644 [0,2,0,0,0,0|2,0,0]=4 3383 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 7a_100000144662_200025704644 [0,2,0,0,0,0|2,0,0]=4 3384 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)Br 34a_100010090037_200025704644 [0,2,0,0,0,0|2,0,0]=4 3385 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)O 34a_100000034668_200025704644 [0,2,0,0,0,0|2,0,0]=4 3386 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 3387 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 3388 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 3389 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 3390 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [0,2,0,0,0,0|2,0,0]=4 3391 B12R2.315 C=Cc1cccc2c1cc[nH]2 271570a_100011290941_100000685724 [0,0,1,1,0,0|2,0,0]=4 3392 B12R2.315 C=Cc1cccc2c1cco2 271570a_100011290941_100000756496 [0,0,1,1,0,0|2,0,0]=4 3393 B12R2.315 C=Cc1cccc2c1ccs2 271570a_100011290941_100009816950 [0,0,1,1,0,0|2,0,0]=4 3394 B12R2.315 C=Cc1nc[nH]c-2nccc12 271570a_100011290941_100015350423 [0,0,1,1,0,0|2,0,0]=4 3395 B12R2.315 C=Cc1nccc2c1[nH]cc2 271570a_100011290941_100009816714 [0,0,1,1,0,0|1,0,1]=4 3396 B12R2.315 C=Cc1nccc2c1cc[nH]2 271570a_100011290941_100000086534 [0,0,1,1,0,0|1,0,0]=3 3397 B12R2.315 C=Cc1nccc2c1cco2 271570a_100011290941_100000041166 [0,0,1,1,0,0|1,0,0]=3 3398 B12R2.315 C=Cc1nccc2c1ccs2 271570a_100011290941_100000047778 [0,0,1,1,0,0|1,0,0]=3 3399 B12R2.315 C=Cc1nccc2c1cn[nH]2 271570a_100011290941_100102525074 [0,0,1,1,0,0|2,0,0]=4 3400 B12R2.315 C=Cc1nccc2c1nc[nH]2 271570a_100011290941_100009820035 [0,0,1,1,0,0|2,0,0]=4 3401 B12R2.315 C=Cc1nccc2c1scc2 271570a_100011290941_100000117209 [0,0,1,1,0,0|1,0,1]=4 3402 B12R2.315 C=Cc1nccn2c1ccc2 271570a_100011290941_100000094558 [0,0,1,1,0,0|1,0,1]=4 3403 B12R2.315 C=Cc1nccn2c1ccn2 271570a_100011290941_100009846796 [0,0,1,1,0,0|2,0,0]=4 3404 B12R2.315 C=Cc1ncnc2c1cco2 271570a_100011290941_100000094286 [0,0,1,1,0,0|2,0,0]=4 3405 B12R2.315 C=Cc1ncnc2c1ccs2 271570a_100011290941_100000183654 [0,0,1,1,0,0|2,0,0]=4 3406 B12R2.2048 C=Cc1ncccc1C2CC2 271570a_100011290941_100009851976 [0,0,1,1,0,0|0,0,2]=4 3407 B12R2.2057 C(=CC1CC1)c2ccccn2 271570a_100102526188_100011216584 [0,0,1,1,0,0|0,0,2]=4 3408 B12R2.221 Cc1ccc(c2c1[nH]cc2)O 271570a_203496583355_100009820812 [0,0,1,1,0,0|2,0,0]=4 3409 B12R2.221 Cc1ccc(c2c1cc[nH]2)O 271570a_203496583355_100010219157 [0,0,1,1,0,0|2,0,0]=4 3410 B12R2.221 Cc1ccc(c2c1cco2)O 271570a_203496583355_100010253976 [0,0,1,1,0,0|2,0,0]=4 3411 B10R1.5 CC=Cc1ccoc1C=O 271570a_100016259895_100000756499 [0,0,1,0,1,0|2,0,0]=4 3412 B10R1.5 CC=Cc1ccsc1C=O 271570a_100016259895_100000766043 [0,0,1,0,1,0|2,0,0]=4 3413 B10R1.5 CC=Cc1cscc1C=O 271570a_100016259895_100000685484 [0,0,1,0,1,0|2,0,0]=4 3414 B10R1.5 CC=Cc1sccc1C=O 271570a_100016259895_100009816921 [0,0,1,0,1,0|2,0,0]=4 3415 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [0,0,1,0,1,0|1,0,1]=4 3416 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [0,0,1,0,1,0|2,0,0]=4 3417 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,0,1,0,1,0|1,0,1]=4 3418 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [0,0,1,0,1,0|2,0,0]=4 3419 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [0,0,1,0,1,0|2,0,0]=4 3420 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [0,0,1,0,1,0|2,0,0]=4 3421 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [0,0,1,0,1,0|2,0,0]=4 3422 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [0,0,1,0,1,0|1,0,0]=3 3423 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [0,0,1,0,1,0|0,0,1]=3 3424 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [0,0,1,0,1,0|1,0,0]=3 3425 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [0,0,1,0,1,0|1,0,0]=3 3426 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [0,0,1,0,1,0|1,0,0]=3 3427 B10R1.61 C=C(C)c1cncnc1Br 271570a_100000694244_200012461658 [0,0,1,0,1,0|2,0,0]=4 3428 B10R1.61 C=C(C)c1cncnc1C 271570a_100000694244_100009819671 [0,0,1,0,1,0|1,0,1]=4 3429 B10R1.61 C=C(C)c1cncnc1Cl 271570a_100000694244_100000758962 [0,0,1,0,1,0|2,0,0]=4 3430 B10R1.61 C=C(C)c1cncnc1N 271570a_100000694244_100011996079 [0,0,1,0,1,0|2,0,0]=4 3431 B10R1.61 C=C(C)c1cncnc1O 271570a_100000694244_100000751107 [0,0,1,0,1,0|2,0,0]=4 3432 B10R1.61 C=C(C)c1nccnc1C 271570a_100000694244_100011999405 [0,0,1,0,1,0|1,0,1]=4 3433 B10R1.61 C=C(C)c1nccnc1F 271570a_100000694244_200010125657 [0,0,1,0,1,0|2,0,0]=4 3434 B10R1.61 C=C(C)c1nccnc1N 271570a_100000694244_100000747729 [0,0,1,0,1,0|2,0,0]=4 3435 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [0,0,1,0,1,0|2,0,0]=4 3436 B10R1.66 CC(=O)C=Cc1c[nH]cn1 1458a_100102678534_200000210301 [0,0,1,0,1,0|2,0,0]=4 3437 B10R1.66 CC(=O)C=Cc1cccs1 1458a_100000182767_200000210301 [0,0,1,0,1,0|2,0,0]=4 3438 B10R1.66 CC(=O)C=Cc1ccoc1 1458a_100000238621_200000210301 [0,0,1,0,1,0|2,0,0]=4 3439 B10R1.66 CC(=O)C=Cc1ccsc1 1458a_100000698588_200000210301 [0,0,1,0,1,0|2,0,0]=4 3440 B10R1.66 CC(=O)C=Cc1cscn1 1458a_200000747928_200000210301 [0,0,1,0,1,0|2,0,0]=4 3441 B10R1.66 CC(=O)C=Cc1nccs1 1458a_100102558208_200000210301 [0,0,1,0,1,0|2,0,0]=4 3442 B10R1.66 [13CH3]C(=O)C=Cc1c[nH]cn1 1458a_100102678534_200025704644 [0,0,1,0,1,0|2,0,0]=4 3443 B10R1.66 [13CH3]C(=O)C=Cc1cccs1 1458a_100000182767_200025704644 [0,0,1,0,1,0|2,0,0]=4 3444 B10R1.66 [13CH3]C(=O)C=Cc1ccoc1 1458a_100000238621_200025704644 [0,0,1,0,1,0|2,0,0]=4 3445 B10R1.66 [13CH3]C(=O)C=Cc1ccsc1 1458a_100000698588_200025704644 [0,0,1,0,1,0|2,0,0]=4 3446 B10R1.66 [13CH3]C(=O)C=Cc1cscn1 1458a_200000747928_200025704644 [0,0,1,0,1,0|2,0,0]=4 3447 B10R1.66 [13CH3]C(=O)C=Cc1nccs1 1458a_100102558208_200025704644 [0,0,1,0,1,0|2,0,0]=4 3448 B12R1.252 C=C(C)C=NNc1ccccc1 4a_100015195140_100000210575 [0,0,1,0,0,1|2,0,0]=4 3449 B12R1.252 C=C(C)C=NNc1ccccn1 4a_100000183288_100000210575 [0,0,1,0,0,1|1,0,0]=3 3450 B12R1.252 C=C(C)C=NNc1cccnn1 4a_100000757824_100000210575 [0,0,1,0,0,1|2,0,0]=4 3451 B12R1.252 C=C(C)C=NNc1ccncn1 4a_100011438088_100000210575 [0,0,1,0,0,1|2,0,0]=4 3452 B12R1.252 C=C(C)C=NNc1cnccn1 4a_100000736894_100000210575 [0,0,1,0,0,1|2,0,0]=4 3453 B12R1.252 C=C(C)C=NNc1ncccn1 4a_100000736892_100000210575 [0,0,1,0,0,1|2,0,0]=4 3454 B12R1.252 C=C(C)CCSc1ccccn1 62a_100000730704_100011216584 [0,0,1,0,0,1|0,0,2]=4 3455 B12R1.252 C=C(C)CCSc1ccccn1 62a_100011216584_100000730704 [0,0,1,0,0,1|0,0,2]=4 3456 B12R1.252 C=C(C)COCc1ccccn1 34a_100000210245_100000721315 [0,0,1,0,0,1|0,0,2]=4 3457 B12R1.252 C=C(C)CSCc1ccccn1 62a_100000721315_100000211660 [0,0,1,0,0,1|0,0,2]=4 3458 B12R1.252 C=C(C)CSCc1ccccn1 62a_100000748629_100000721315 [0,0,1,0,0,1|0,0,2]=4 3459 B12R1.252 CC(=CCSc1ccccn1)C 62a_100000761012_100011216584 [0,0,1,0,0,1|0,0,2]=4 3460 B12R1.252 CC(=CCSc1ccccn1)C 62a_100011216584_100000761012 [0,0,1,0,0,1|0,0,2]=4 3461 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [0,0,1,0,0,1|2,0,0]=4 3462 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [0,0,1,0,0,1|2,0,0]=4 3463 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [0,0,1,0,0,1|2,0,0]=4 3464 B12R1.252 CC(=O)NN=Cc1ccccn1 4a_100000189765_100000209966 [0,0,1,0,0,1|2,0,0]=4 3465 B12R1.252 CC(C)CC=Cc1ccccn1 271570a_100016259101_100011216584 [0,0,1,0,0,1|0,0,2]=4 3466 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [0,0,1,0,0,1|2,0,0]=4 3467 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [0,0,1,0,0,1|2,0,0]=4