0 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,0|2,0,1]=3 1 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,0|1,0,1]=2 2 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,0|0,0,2]=2 3 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [0,0,0,0,0,0|1,0,2]=3 5 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [0,0,0,0,0,0|2,0,1]=3 6 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [0,0,0,0,0,0|1,0,2]=3 7 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [0,0,0,0,0,0|2,0,1]=3 8 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.24 Oc1ccc2cnncc2c1 271570a_203496583355_100010198781 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [0,0,0,0,0,0|2,0,1]=3 11 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [0,0,0,0,0,0|1,0,2]=3 12 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [0,0,0,0,0,0|3,0,1]=4 13 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [0,0,0,0,0,0|2,0,2]=4 14 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [0,0,0,0,0,0|3,0,1]=4 15 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [0,0,0,0,0,0|3,0,1]=4 16 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,0|2,0,1]=3 17 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,0|1,0,2]=3 18 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [0,0,0,0,0,0|3,0,1]=4 19 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [0,0,0,0,0,0|2,0,2]=4 20 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,0|1,0,2]=3 21 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,0|1,0,1]=3 22 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,1,0,0,0,0|2,0,1]=4 23 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,1,0,0,0,0|2,0,1]=4 24 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,0,0,0|2,0,0]=3 25 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,1,0,0,0,0|3,0,0]=4 26 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,0|1,0,1]=3 28 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [0,1,0,0,0,0|2,0,1]=4 29 B13R2.32 Nc1c(ccc2c1ccnc2)O 271570a_203496583355_100010191621 [0,1,0,0,0,0|2,0,1]=4 30 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,1,0,0,0,0|2,0,1]=4 31 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,1,0,0,0,0|2,0,1]=4 32 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,0,0,0|2,0,0]=3 33 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,1,0,0,0,0|3,0,0]=4 35 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [0,1,0,0,0,0|3,0,0]=4 36 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,1,0,0,0,0|3,0,0]=4 37 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,0|2,0,1]=4 38 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,1,0,0,0,0|2,0,1]=4 39 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,0,0,0|2,0,0]=3 40 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [0,1,0,0,0,0|3,0,0]=4 41 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [0,1,0,0,0,0|3,0,0]=4 42 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [0,1,0,0,0,0|3,0,0]=4 43 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,0|1,0,1]=3 44 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,0|1,0,1]=3 45 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,0|1,0,1]=3 46 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,0|1,0,1]=3 47 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [0,1,0,0,0,0|2,0,1]=4 48 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,1,0,0,0,0|2,0,1]=4 49 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,1,0,0,0,0|2,0,1]=4 50 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [0,1,0,0,0,0|2,0,1]=4 51 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,1,0,0,0,0|2,0,1]=4 52 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [0,1,0,0,0,0|3,0,0]=4 53 B13R2.57 C=Cc1ccc2ccccc2c1 271570a_100011290941_100000233703 [0,1,0,0,0,0|2,0,0]=3 54 B13R2.57 C=Cc1ccc2ccccc2n1 271570a_100011290941_100011291633 [0,1,0,0,0,0|1,0,1]=3 55 B13R2.57 C=Cc1ccc2cccnc2c1 271570a_100011290941_100009816655 [0,1,0,0,0,0|3,0,0]=4 56 B13R2.57 C=Cc1ccc2cccnc2n1 271570a_100011290941_100009888989 [0,1,0,0,0,0|2,0,1]=4 57 B13R2.57 C=Cc1ccc2ccncc2c1 271570a_100011290941_100000686496 [0,1,0,0,0,0|3,0,0]=4 58 B13R2.57 C=Cc1ccc2ccncc2n1 271570a_100011290941_100000020162 [0,1,0,0,0,0|2,0,1]=4 59 B13R2.57 C=Cc1ccc2cnccc2c1 271570a_100011290941_100009816743 [0,1,0,0,0,0|3,0,0]=4 60 B13R2.57 C=Cc1ccc2ncccc2c1 271570a_100011290941_100000754243 [0,1,0,0,0,0|3,0,0]=4 61 B13R2.57 C=Cc1ccc2ncccc2n1 271570a_100011290941_100000073381 [0,1,0,0,0,0|2,0,1]=4 62 B13R2.57 C=Cc1cnc2ccccc2c1 271570a_100011290941_100000737414 [0,1,0,0,0,0|3,0,0]=4 63 B13R2.57 C=Cc1cnc2ccccc2n1 271570a_100011290941_100000756483 [0,1,0,0,0,0|2,0,1]=4 64 B13R2.57 C=Cc1ncc2ccccc2n1 271570a_100011290941_100000097389 [0,1,0,0,0,0|2,0,1]=4 65 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,1,0,0,0,0|2,0,0]=3 66 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,1,0,0,0,0|2,0,0]=3 67 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [0,1,0,0,0,0|1,0,1]=3 68 B13R2.57 CNc1ccc2cccnc2c1 34a_100102887122_200000210301 [0,1,0,0,0,0|3,0,0]=4 69 B13R2.57 CNc1ccc2cccnc2n1 27a_100102657272_100000075685 [0,1,0,0,0,0|2,0,1]=4 70 B13R2.57 CNc1ccc2ccncc2n1 27a_100102657272_100000020162 [0,1,0,0,0,0|2,0,1]=4 71 B13R2.57 CNc1ccc2cnccc2c1 34a_100000039641_200000210301 [0,1,0,0,0,0|3,0,0]=4 72 B13R2.57 CNc1ccc2ncccc2c1 34a_100011198106_200000210301 [0,1,0,0,0,0|3,0,0]=4 73 B13R2.57 CNc1ccc2ncccc2n1 27a_100102657272_100000073381 [0,1,0,0,0,0|2,0,1]=4 74 B13R2.57 CNc1cnc2ccccc2n1 27a_100102657272_100000756483 [0,1,0,0,0,0|2,0,1]=4 75 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [0,1,0,0,0,0|2,0,1]=4 76 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,1,0,0,0,0|1,0,1]=3 77 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,1,0,0,0,0|1,0,1]=3 78 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [0,1,0,0,0,0|2,0,1]=4 79 B13R2.57 COc1ccc2ccncc2c1 7a_100000752006_200000210301 [0,1,0,0,0,0|2,0,1]=4 80 B13R2.57 COc1ccc2cnccc2c1 34a_100000046372_200000210301 [0,1,0,0,0,0|2,0,1]=4 81 B13R2.57 COc1ccc2cnccc2c1 7a_100000046372_200000210301 [0,1,0,0,0,0|2,0,1]=4 82 B13R2.57 COc1ccc2ncccc2c1 34a_100011215586_200000210301 [0,1,0,0,0,0|2,0,1]=4 83 B13R2.57 COc1ccc2ncccc2c1 7a_100011215586_200000210301 [0,1,0,0,0,0|2,0,1]=4 84 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,1,0,0,0,0|2,0,1]=4 85 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,1,0,0,0,0|2,0,1]=4 86 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [0,1,0,0,0,0|2,1,0]=4 87 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [0,1,0,0,0,0|2,1,0]=4 88 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [0,1,0,0,0,0|1,1,0]=3 89 B13R2.57 CSc1ccc2ccccc2n1 62a_100011291633_200000210301 [0,1,0,0,0,0|0,1,1]=3 90 B13R2.57 CSc1ccc2ccccc2n1 62a_200000210301_100011291633 [0,1,0,0,0,0|0,1,1]=3 91 B13R2.57 CSc1ccc2cccnc2c1 62a_200000210301_100009816655 [0,1,0,0,0,0|2,1,0]=4 92 B13R2.57 CSc1ccc2cccnc2n1 62a_100000075685_200000210301 [0,1,0,0,0,0|1,1,1]=4 93 B13R2.57 CSc1ccc2cccnc2n1 62a_200000210301_100000075685 [0,1,0,0,0,0|1,1,1]=4 94 B13R2.57 CSc1ccc2ccncc2c1 62a_100000686496_200000210301 [0,1,0,0,0,0|2,1,0]=4 95 B13R2.57 CSc1ccc2ccncc2c1 62a_200000210301_100000686496 [0,1,0,0,0,0|2,1,0]=4 96 B13R2.57 CSc1ccc2ccncc2n1 62a_200000210301_100000020162 [0,1,0,0,0,0|1,1,1]=4 97 B13R2.57 CSc1ccc2cnccc2c1 62a_100009816743_200000210301 [0,1,0,0,0,0|2,1,0]=4 98 B13R2.57 CSc1ccc2cnccc2c1 62a_200000210301_100009816743 [0,1,0,0,0,0|2,1,0]=4 99 B13R2.57 CSc1ccc2ncccc2c1 62a_100011215947_200000210301 [0,1,0,0,0,0|2,1,0]=4 100 B13R2.57 CSc1ccc2ncccc2c1 62a_200000210301_100011215947 [0,1,0,0,0,0|2,1,0]=4 101 B13R2.57 CSc1ccc2ncccc2n1 62a_200000210301_100000073381 [0,1,0,0,0,0|1,1,1]=4 102 B13R2.57 CSc1cnc2ccccc2c1 62a_200000210301_100000737414 [0,1,0,0,0,0|2,1,0]=4 103 B13R2.57 CSc1cnc2ccccc2n1 62a_100000756483_200000210301 [0,1,0,0,0,0|1,1,1]=4 104 B13R2.57 CSc1cnc2ccccc2n1 62a_200000210301_100000756483 [0,1,0,0,0,0|1,1,1]=4 105 B13R2.57 CSc1ncc2ccccc2n1 62a_200000210301_100000097389 [0,1,0,0,0,0|1,1,1]=4 106 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,1,0,0,0,0|2,0,0]=3 107 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,1,0,0,0,0|2,0,0]=3 108 B13R2.57 [13CH3]Nc1ccc2cccnc2c1 34a_100102887122_200025704644 [0,1,0,0,0,0|3,0,0]=4 109 B13R2.57 [13CH3]Nc1ccc2cnccc2c1 34a_100000039641_200025704644 [0,1,0,0,0,0|3,0,0]=4 110 B13R2.57 [13CH3]Nc1ccc2ncccc2c1 34a_100011198106_200025704644 [0,1,0,0,0,0|3,0,0]=4 111 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,1,0,0,0,0|1,0,1]=3 112 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,1,0,0,0,0|1,0,1]=3 113 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [0,1,0,0,0,0|2,0,1]=4 114 B13R2.57 [13CH3]Oc1ccc2ccncc2c1 7a_100000752006_200025704644 [0,1,0,0,0,0|2,0,1]=4 115 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 34a_100000046372_200025704644 [0,1,0,0,0,0|2,0,1]=4 116 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 7a_100000046372_200025704644 [0,1,0,0,0,0|2,0,1]=4 117 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 34a_100011215586_200025704644 [0,1,0,0,0,0|2,0,1]=4 118 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 7a_100011215586_200025704644 [0,1,0,0,0,0|2,0,1]=4 119 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,1,0,0,0,0|2,0,1]=4 120 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,1,0,0,0,0|2,0,1]=4 121 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [0,1,0,0,0,0|2,1,0]=4 122 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [0,1,0,0,0,0|2,1,0]=4 123 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [0,1,0,0,0,0|1,1,0]=3 124 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_100011291633_200025704644 [0,1,0,0,0,0|0,1,1]=3 125 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_200025704644_100011291633 [0,1,0,0,0,0|0,1,1]=3 126 B13R2.57 [13CH3]Sc1ccc2cccnc2c1 62a_200025704644_100009816655 [0,1,0,0,0,0|2,1,0]=4 127 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_100000075685_200025704644 [0,1,0,0,0,0|1,1,1]=4 128 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_200025704644_100000075685 [0,1,0,0,0,0|1,1,1]=4 129 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_100000686496_200025704644 [0,1,0,0,0,0|2,1,0]=4 130 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_200025704644_100000686496 [0,1,0,0,0,0|2,1,0]=4 131 B13R2.57 [13CH3]Sc1ccc2ccncc2n1 62a_200025704644_100000020162 [0,1,0,0,0,0|1,1,1]=4 132 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_100009816743_200025704644 [0,1,0,0,0,0|2,1,0]=4 133 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_200025704644_100009816743 [0,1,0,0,0,0|2,1,0]=4 134 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_100011215947_200025704644 [0,1,0,0,0,0|2,1,0]=4 135 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_200025704644_100011215947 [0,1,0,0,0,0|2,1,0]=4 136 B13R2.57 [13CH3]Sc1ccc2ncccc2n1 62a_200025704644_100000073381 [0,1,0,0,0,0|1,1,1]=4 137 B13R2.57 [13CH3]Sc1cnc2ccccc2c1 62a_200025704644_100000737414 [0,1,0,0,0,0|2,1,0]=4 138 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_100000756483_200025704644 [0,1,0,0,0,0|1,1,1]=4 139 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_200025704644_100000756483 [0,1,0,0,0,0|1,1,1]=4 140 B13R2.57 [13CH3]Sc1ncc2ccccc2n1 62a_200025704644_100000097389 [0,1,0,0,0,0|1,1,1]=4 141 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [0,1,0,0,0,0|1,0,1]=3 142 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [0,1,0,0,0,0|2,0,1]=4 143 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [0,1,0,0,0,0|2,0,1]=4 144 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [0,1,0,0,0,0|2,0,1]=4 145 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [0,1,0,0,0,0|2,0,1]=4 146 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [0,1,0,0,0,0|1,0,1]=3 147 B13R2.155 Nc1ccc2ccc(cc2n1)O 271570a_203496583355_100010187616 [0,1,0,0,0,0|1,0,1]=3 148 B13R2.155 Nc1ccc2ccc(nc2n1)O 271570a_203496583355_100000117679 [0,1,0,0,0,0|1,0,2]=4 149 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [0,1,0,0,0,0|2,0,1]=4 150 B13R2.155 Nc1cnc2ccc(cc2n1)O 271570a_203496583355_100010090528 [0,1,0,0,0,0|2,0,1]=4 151 B13R2.155 Nc1ncc2ccc(cc2n1)O 271570a_203496583355_100010199760 [0,1,0,0,0,0|2,0,1]=4 152 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,1,0,0,0,0|1,0,2]=4 153 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,1,0,0,0,0|0,0,2]=3 154 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,0,0,0|1,0,1]=3 155 B13R2.155 O=C1COc2ccc(nc2N1)O 271570a_203496583355_100010235088 [0,1,0,0,0,0|2,0,1]=4 156 B13R2.155 O=C1COc2ncc(cc2N1)O 271570a_203496583355_100000699640 [0,1,0,0,0,0|2,0,1]=4 157 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [0,1,0,0,0,0|1,0,1]=3 158 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [0,1,0,0,0,0|1,0,1]=3 159 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,0,0,0|1,0,1]=3 160 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [0,1,0,0,0,0|1,0,0]=2 161 B13R2.155 O=c1ccc2cnc(cc2[nH]1)O 271570a_203496583355_100010563892 [0,1,0,0,0,0|1,0,0]=2 162 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [0,1,0,0,0,0|2,0,1]=4 163 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [0,1,0,0,0,0|1,0,1]=3 164 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [0,1,0,0,0,0|0,0,2]=3 165 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [0,1,0,0,0,0|0,0,2]=3 166 B13R2.155 Oc1ccc2ccc(nc2n1)O 271570a_203496583355_200010218124 [0,1,0,0,0,0|1,0,2]=4 167 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [0,1,0,0,0,0|2,0,1]=4 168 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [0,1,0,0,0,0|2,0,1]=4 169 B13R2.155 Oc1ccc2ncc(cc2c1)Br 271570a_203496583355_200010254249 [0,1,0,0,0,0|2,0,1]=4 170 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [0,1,0,0,0,0|2,0,1]=4 171 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [0,1,0,0,0,0|2,0,1]=4 172 B13R2.155 Oc1ccc2ncc(cc2n1)F 271570a_203496583355_100009889179 [0,1,0,0,0,0|1,0,2]=4 173 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [0,1,0,0,0,0|1,0,2]=4 174 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [0,1,0,0,0,0|1,0,2]=4 175 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [0,1,0,0,0,0|2,0,1]=4 176 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [0,1,0,0,0,0|2,0,1]=4 177 B13R2.155 Oc1cnc2ccc(nc2c1)O 271570a_203496583355_100010009477 [0,1,0,0,0,0|1,0,2]=4 178 B13R2.155 Oc1ncc2ccc(cc2n1)F 271570a_203496583355_100000104070 [0,1,0,0,0,0|1,0,2]=4 179 B13R2.155 [O-][n+]1ccc2ccc(cc2c1)O 271570a_203496583355_100009816120 [0,1,0,0,0,0|2,0,1]=4 180 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,1,0,0,0,0|1,0,1]=3 181 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [0,1,0,0,0,0|3,0,0]=4 182 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [0,1,0,0,0,0|3,0,0]=4 183 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [0,1,0,0,0,0|2,0,1]=4 184 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,0|1,0,1]=3 185 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,0|0,0,2]=3 186 B13R2.162 Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100009817033 [0,1,0,0,0,0|2,0,1]=4 187 B13R2.162 Cc1nccc2c1cc(cc2)O 271570a_203496583355_200010739692 [0,1,0,0,0,0|2,0,1]=4 188 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [0,1,0,0,0,0|1,0,1]=3 189 B13R2.162 Nc1ccc2nccc(c2c1)O 271570a_203496583355_100009879071 [0,1,0,0,0,0|3,0,0]=4 190 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,0|1,0,1]=3 191 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,0|2,0,1]=4 192 B13R2.162 Nc1ccnc2c1cc(cc2)O 271570a_203496583355_100011620571 [0,1,0,0,0,0|2,0,1]=4 193 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [0,1,0,0,0,0|2,0,1]=4 194 B13R2.162 Nc1nccc2c1cc(cc2)O 271570a_203496583355_100012352255 [0,1,0,0,0,0|2,0,1]=4 195 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,1,0,0,0,0|1,0,2]=4 196 B13R2.162 O=c1cc[nH]c2c1cc(cc2)O 271570a_203496583355_100000746092 [0,1,0,0,0,0|2,0,1]=4 197 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,0|0,0,0]=1 198 B13R2.162 O=c1ccoc2c1cc(cc2)O 271570a_203496583355_100009813387 [0,1,0,0,0,0|2,0,1]=4 199 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,0|1,0,1]=3 200 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,0|1,0,1]=3 201 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,0|0,0,2]=3 202 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,0|0,0,2]=3 203 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_100000010956 [0,1,0,0,0,0|2,0,1]=4 204 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_200009844553 [0,1,0,0,0,0|2,0,1]=4 205 B13R2.162 Oc1ccc2cncc(c2c1)O 271570a_203496583355_100010136424 [0,1,0,0,0,0|2,0,1]=4 206 B13R2.162 Oc1ccc2cncc(c2n1)O 271570a_203496583355_100009812673 [0,1,0,0,0,0|1,0,2]=4 207 B13R2.162 Oc1ccc2nccc(c2c1)Cl 271570a_203496583355_100011310491 [0,1,0,0,0,0|2,0,1]=4 208 B13R2.162 Oc1ccc2nccc(c2c1)O 271570a_203496583355_100000075933 [0,1,0,0,0,0|2,0,1]=4 209 B13R2.162 Oc1ccnc2c1cc(cc2)Br 271570a_203496583355_100010189052 [0,1,0,0,0,0|3,0,0]=4 210 B13R2.162 Oc1ccnc2c1cc(cc2)F 271570a_203496583355_100011217270 [0,1,0,0,0,0|3,0,0]=4 211 B13R2.162 Oc1ccnc2c1nc(cc2)F 271570a_203496583355_100000719316 [0,1,0,0,0,0|2,0,1]=4 212 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,0|2,0,1]=4 213 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [0,1,0,0,0,0|1,0,2]=4 214 B13R2.162 Oc1nccc2c1cc(cc2)F 271570a_203496583355_100010202866 [0,1,0,0,0,0|3,0,0]=4 215 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [0,1,0,0,0,0|1,0,1]=3 216 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [0,1,0,0,0,0|2,0,1]=4 217 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [0,1,0,0,0,0|3,0,0]=4 218 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [0,1,0,0,0,0|2,0,1]=4 219 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,0|0,0,2]=3 220 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,0,0,0|3,0,0]=4 221 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [0,1,0,0,0,0|2,0,1]=4 222 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [0,1,0,0,0,0|1,0,2]=4 223 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [0,1,0,0,0,0|2,0,0]=3 224 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,0|1,0,1]=3 225 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [0,1,0,0,0,0|2,0,1]=4 226 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [0,1,0,0,0,0|2,0,1]=4 227 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [0,1,0,0,0,0|0,0,2]=3 228 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [0,1,0,0,0,0|3,0,0]=4 229 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [0,1,0,0,0,0|2,0,1]=4 230 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,0|0,0,1]=2 231 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,0|0,0,0]=1 232 B13R2.328 O=c1cc(c2cccnc2[nH]1)O 271570a_203496583355_100010499609 [0,1,0,0,0,0|1,0,0]=2 233 B13R2.328 O=c1cc(nc2n1cccc2)O 271570a_203496583355_100000707704 [0,1,0,0,0,0|1,0,2]=4 234 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,0|1,0,1]=3 235 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,0|1,0,1]=3 236 B13R2.328 Oc1cc(c2cnccc2c1)F 271570a_203496583355_100011068762 [0,1,0,0,0,0|2,0,1]=4 237 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [0,1,0,0,0,0|2,0,1]=4 238 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [0,1,0,0,0,0|2,0,1]=4 239 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [0,1,0,0,0,0|2,0,1]=4 240 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [0,1,0,0,0,0|2,0,1]=4 241 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [0,1,0,0,0,0|3,0,0]=4 242 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [0,1,0,0,0,0|3,0,0]=4 243 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [0,1,0,0,0,0|2,0,1]=4 244 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [0,1,0,0,0,0|2,0,1]=4 245 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,1,0,0,0,0|0,0,2]=3 246 B13R2.369 Cc1cc2cccnc2nc1O 271570a_203496583355_100009877248 [0,1,0,0,0,0|1,0,2]=4 247 B13R2.369 Cc1cc2ncccc2cc1O 271570a_203496583355_100010137429 [0,1,0,0,0,0|2,0,1]=4 248 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [0,1,0,0,0,0|1,0,2]=4 249 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [0,1,0,0,0,0|1,0,1]=3 250 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [0,1,0,0,0,0|1,0,1]=3 251 B13R2.369 Nc1nc2ccccc2nc1O 271570a_203496583355_100000009970 [0,1,0,0,0,0|1,0,2]=4 252 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,1,0,0,0,0|1,0,0]=2 253 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [0,1,0,0,0,0|1,0,1]=3 254 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [0,1,0,0,0,0|1,0,1]=3 255 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [0,1,0,0,0,0|1,0,1]=3 256 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [0,1,0,0,0,0|1,0,1]=3 257 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [0,1,0,0,0,0|1,0,1]=3 258 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [0,1,0,0,0,0|0,0,2]=3 259 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [0,1,0,0,0,0|0,0,2]=3 260 B13R2.369 Oc1cc2cccnc2cc1F 271570a_203496583355_100009854028 [0,1,0,0,0,0|2,0,1]=4 261 B13R2.369 Oc1cc2cccnc2cc1O 271570a_203496583355_200010153759 [0,1,0,0,0,0|2,0,1]=4 262 B13R2.369 Oc1cc2ccncc2cc1F 271570a_203496583355_100011105921 [0,1,0,0,0,0|2,0,1]=4 263 B13R2.369 Oc1cc2cnccc2cc1F 271570a_203496583355_100010244713 [0,1,0,0,0,0|2,0,1]=4 264 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [0,1,0,0,0,0|0,0,2]=3 265 B13R2.3683 C[n+]1ccc2cc(ccc2c1)O 271570a_203496583355_100015191232 [0,1,0,0,0,0|2,0,1]=4 266 B13R2.3683 Cc1ccc2cc(ccc2n1)O 271570a_203496583355_100000686635 [0,1,0,0,0,0|1,0,1]=3 267 B13R2.3683 Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100011865911 [0,1,0,0,0,0|0,0,2]=3 268 B13R2.3683 Cc1ccc2nc(ccc2n1)O 271570a_203496583355_200009884078 [0,1,0,0,0,0|1,0,2]=4 269 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [0,1,0,0,0,0|2,0,1]=4 270 B13R2.3683 Nc1cc2ccc(cc2cn1)O 271570a_203496583355_100010232990 [0,1,0,0,0,0|2,0,1]=4 271 B13R2.3683 Nc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185457 [0,1,0,0,0,0|1,0,1]=3 272 B13R2.3683 Nc1ccc2cc(ccc2n1)O 271570a_203496583355_100011934619 [0,1,0,0,0,0|1,0,1]=3 273 B13R2.3683 Nc1ccc2cc(cnc2c1)O 271570a_203496583355_200010264087 [0,1,0,0,0,0|2,0,1]=4 274 B13R2.3683 Nc1ccc2cc(cnc2n1)O 271570a_203496583355_100010214896 [0,1,0,0,0,0|2,0,1]=4 275 B13R2.3683 Nc1ccc2nc(cnc2c1)O 271570a_203496583355_100009885871 [0,1,0,0,0,0|1,0,2]=4 276 B13R2.3683 Nc1cnc2cc(ccc2c1)O 271570a_203496583355_100010142226 [0,1,0,0,0,0|2,0,1]=4 277 B13R2.3683 Nc1ncc2cc(ccc2n1)O 271570a_203496583355_100010138702 [0,1,0,0,0,0|2,0,1]=4 278 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,1,0,0,0,0|1,0,2]=4 279 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,1,0,0,0,0|0,0,2]=3 280 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,1,0,0,0,0|1,0,2]=4 281 B13R2.3683 O=C1CCc2cc(cnc2N1)O 271570a_203496583355_100010162403 [0,1,0,0,0,0|1,0,2]=4 282 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,1,0,0,0,0|1,0,1]=3 283 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,1,0,0,0,0|1,0,1]=3 284 B13R2.3683 O=C1COc2cc(cnc2N1)O 271570a_203496583355_100010209494 [0,1,0,0,0,0|2,0,1]=4 285 B13R2.3683 O=C1COc2nc(ccc2N1)O 271570a_203496583355_100010201792 [0,1,0,0,0,0|2,0,1]=4 286 B13R2.3683 O=C1CSc2cc(ccc2N1)O 271570a_203496583355_100011830382 [0,1,0,0,0,0|1,0,1]=3 287 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,1,0,0,0,0|2,0,1]=4 288 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,1,0,0,0,0|1,0,1]=3 289 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,1,0,0,0,0|1,0,1]=3 290 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,1,0,0,0,0|0,0,0]=1 291 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,1,0,0,0,0|1,0,0]=2 292 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,1,0,0,0,0|1,0,0]=2 293 B13R2.3683 O=c1cnc2cc(cnc2[nH]1)O 271570a_203496583355_200010159638 [0,1,0,0,0,0|2,0,0]=3 294 B13R2.3683 Oc1ccc2cc(ccc2c1)Br 271570a_203496583355_100012344972 [0,1,0,0,0,0|1,0,1]=3 295 B13R2.3683 Oc1ccc2cc(ccc2c1)F 271570a_203496583355_100009817052 [0,1,0,0,0,0|1,0,1]=3 296 B13R2.3683 Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185455 [0,1,0,0,0,0|1,0,1]=3 297 B13R2.3683 Oc1ccc2cc(ccc2n1)F 271570a_203496583355_100011998705 [0,1,0,0,0,0|0,0,2]=3 298 B13R2.3683 Oc1ccc2cc(cnc2c1)Br 271570a_203496583355_200015509644 [0,1,0,0,0,0|2,0,1]=4 299 B13R2.3683 Oc1ccc2cc(cnc2c1)F 271570a_203496583355_100010751466 [0,1,0,0,0,0|2,0,1]=4 300 B13R2.3683 Oc1ccc2nc(ccc2c1)Cl 271570a_203496583355_200012034268 [0,1,0,0,0,0|1,0,1]=3 301 B13R2.3683 Oc1ccc2nc(ccc2c1)O 271570a_203496583355_100009849208 [0,1,0,0,0,0|0,0,2]=3 302 B13R2.3683 Oc1ccc2nc(cnc2c1)O 271570a_203496583355_200010664160 [0,1,0,0,0,0|1,0,2]=4 303 B13R2.3683 Oc1cnc2cc(ccc2c1)Cl 271570a_203496583355_100015716233 [0,1,0,0,0,0|2,0,1]=4 304 B13R2.3683 Oc1cnc2cc(ccc2c1)O 271570a_203496583355_200010153753 [0,1,0,0,0,0|2,0,1]=4 305 B13R2.3683 Oc1cnc2cc(ccc2n1)F 271570a_203496583355_100000098432 [0,1,0,0,0,0|1,0,2]=4 306 B13R2.3683 Oc1cnc2nc(ccc2c1)O 271570a_203496583355_100009814606 [0,1,0,0,0,0|1,0,2]=4 307 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,0,0,0|1,0,1]=3 308 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [0,1,0,0,0,0|3,0,0]=4 309 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,0|2,0,1]=4 310 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [0,1,0,0,0,0|2,0,1]=4 311 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [0,1,0,0,0,0|3,0,0]=4 312 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [0,1,0,0,0,0|1,0,1]=3 313 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,0|1,0,1]=3 314 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,0|2,0,1]=4 315 B13R2.5179 Nc1ccnc2c1ccc(c2)O 271570a_203496583355_200009816820 [0,1,0,0,0,0|2,0,1]=4 316 B13R2.5179 Nc1ncc2c(cccc2n1)O 271570a_203496583355_100010209551 [0,1,0,0,0,0|2,0,1]=4 317 B13R2.5179 Nc1nccc2c1ccc(c2)O 271570a_203496583355_100000732483 [0,1,0,0,0,0|2,0,1]=4 318 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,0,0,0|1,0,2]=4 319 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,0,0,0|0,0,2]=3 320 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,0,0,0|1,0,2]=4 321 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,0|1,0,1]=3 322 B13R2.5179 O=C1COc2c(ccnc2O)N1 271570a_203496583355_100009863569 [0,1,0,0,0,0|2,0,1]=4 323 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,0|0,0,0]=1 324 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [0,1,0,0,0,0|2,0,1]=4 325 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,1,0,0,0,0|2,0,1]=4 326 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,0|1,0,1]=3 327 B13R2.5179 Oc1ccc2c(ccnc2c1)Cl 271570a_203496583355_100009996786 [0,1,0,0,0,0|2,0,1]=4 328 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045489 [0,1,0,0,0,0|2,0,1]=4 329 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000756855 [0,1,0,0,0,0|2,0,1]=4 330 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100000760485 [0,1,0,0,0,0|2,0,1]=4 331 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100009867704 [0,1,0,0,0,0|2,0,1]=4 332 B13R2.5179 Oc1ccnc2c1ccc(c2)Cl 271570a_203496583355_100012352046 [0,1,0,0,0,0|3,0,0]=4 333 B13R2.5179 Oc1ccnc2c1ccc(c2)F 271570a_203496583355_100000755548 [0,1,0,0,0,0|3,0,0]=4 334 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,0|2,0,1]=4 335 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,0|2,0,1]=4 336 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,0|2,0,1]=4 337 B13R2.5179 Oc1nccc2c1ccc(c2)F 271570a_203496583355_100000097391 [0,1,0,0,0,0|3,0,0]=4 338 B13R2.5179 [O-][n+]1ccc2c(cccc2c1)O 271570a_203496583355_200010126733 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.1 C=CCOc1ccc(=O)[nH]c1 34a_100000075641_100015514636 [0,0,1,0,0,0|1,0,1]=3 340 B11R1.1 C=CCSc1ccc(=O)[nH]c1 62a_100000210623_100000212171 [0,0,1,0,0,0|1,0,1]=3 341 B11R1.1 C=CCSc1ccc(=O)[nH]c1 62a_100000212171_100000210623 [0,0,1,0,0,0|1,0,1]=3 342 B11R1.1 C=CCSc1ccc(=O)[nH]n1 62a_100000210623_100009820020 [0,0,1,0,0,0|2,0,1]=4 343 B11R1.1 C=CCSc1ccc(=O)[nH]n1 62a_100009820020_100000210623 [0,0,1,0,0,0|2,0,1]=4 344 B11R1.1 C=CCSc1cnc(=O)[nH]c1 62a_100000210623_102495366499 [0,0,1,0,0,0|2,0,1]=4 345 B11R1.1 C=CCSc1cnc(=O)[nH]c1 62a_102495366499_100000210623 [0,0,1,0,0,0|2,0,1]=4 346 B11R1.1 O=CCOc1ccc(=O)[nH]c1 34a_100000075641_200009817547 [0,0,1,0,0,0|2,0,1]=4 347 B11R1.1 O=CCSc1ccc(=O)[nH]c1 62a_100000212171_200015260668 [0,0,1,0,0,0|2,0,1]=4 348 B11R1.1 O=CCSc1ccc(=O)[nH]c1 62a_200015260668_100000212171 [0,0,1,0,0,0|2,0,1]=4 349 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,0,1,0,0,0|2,0,1]=4 350 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,0,1,0,0,0|2,0,1]=4 351 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [0,0,1,0,0,0|2,0,1]=4 352 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [0,0,1,0,0,0|2,0,1]=4 353 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,0,1,0,0,0|2,0,1]=4 354 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,0,1,0,0,0|2,0,1]=4 355 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,0,1,0,0,0|2,0,1]=4 356 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,0,1,0,0,0|2,0,1]=4 357 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,0,1,0,0,0|2,0,1]=4 358 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,0,1,0,0,0|1,0,1]=3 359 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,0,1,0,0,0|1,0,1]=3 360 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [0,0,1,0,0,0|1,0,1]=3 361 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [0,0,1,0,0,0|1,0,1]=3 362 B11R1.17 Nc1cccnc1OCC=O 34a_100000746358_200009817547 [0,0,1,0,0,0|2,0,1]=4 363 B11R1.17 Nc1cccnc1SCC=O 62a_100000688686_200015260668 [0,0,1,0,0,0|2,0,1]=4 364 B11R1.17 Nc1cccnc1SCC=O 62a_200015260668_100000688686 [0,0,1,0,0,0|2,0,1]=4 365 B11R1.17 Nc1ccncc1OCC=O 34a_100000753702_200009817547 [0,0,1,0,0,0|2,0,1]=4 366 B11R1.17 Nc1ccncc1SCC=O 62a_100000047001_200015260668 [0,0,1,0,0,0|2,0,1]=4 367 B11R1.17 Nc1ccncc1SCC=O 62a_200015260668_100000047001 [0,0,1,0,0,0|2,0,1]=4 368 B11R1.17 Nc1cnccc1SCC=O 62a_100000756074_200015260668 [0,0,1,0,0,0|2,0,1]=4 369 B11R1.17 Nc1cnccc1SCC=O 62a_200015260668_100000756074 [0,0,1,0,0,0|2,0,1]=4 370 B11R1.17 Nc1ncccc1OCC=O 34a_100000211975_200009817547 [0,0,1,0,0,0|2,0,1]=4 371 B11R1.17 Nc1ncccc1OCC=O 7a_100000211975_200015260668 [0,0,1,0,0,0|2,0,1]=4 372 B11R1.17 Nc1ncccc1SCC=O 62a_100000045569_200015260668 [0,0,1,0,0,0|2,0,1]=4 373 B11R1.17 Nc1ncccc1SCC=O 62a_200015260668_100000045569 [0,0,1,0,0,0|2,0,1]=4 374 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,0,1,0,0,0|1,0,2]=4 375 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [0,0,1,0,0,0|2,0,1]=4 376 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [0,0,1,0,0,0|2,0,1]=4 377 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [0,0,1,0,0,0|2,0,1]=4 378 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [0,0,1,0,0,0|2,0,1]=4 379 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,0,1,0,0,0|2,0,1]=4 380 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,0,1,0,0,0|2,0,1]=4 381 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,0,1,0,0,0|2,0,1]=4 382 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,0,1,0,0,0|2,0,1]=4 383 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,0,1,0,0,0|2,0,1]=4 384 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,0,1,0,0,0|2,0,1]=4 385 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,0,1,0,0,0|2,0,1]=4 386 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,0,1,0,0,0|2,0,1]=4 387 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,0,1,0,0,0|2,0,1]=4 388 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [0,0,1,0,0,0|2,0,1]=4 389 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [0,0,1,0,0,0|2,0,1]=4 390 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [0,0,1,0,0,0|2,0,1]=4 391 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [0,0,1,0,0,0|2,0,1]=4 392 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [0,0,1,0,0,0|2,0,1]=4 393 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [0,0,1,0,0,0|2,0,1]=4 394 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,0,1,0,0,0|2,0,1]=4 395 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,0,1,0,0,0|2,0,1]=4 396 B11R1.24 C=CCOc1cccc(=O)[nH]1 34a_100000033347_100015514636 [0,0,1,0,0,0|1,0,1]=3 397 B11R1.24 C=CCSc1cccc(=O)[nH]1 62a_100000210623_100000752884 [0,0,1,0,0,0|1,0,1]=3 398 B11R1.24 O=CCOc1cccc(=O)[nH]1 34a_100000033347_200009817547 [0,0,1,0,0,0|2,0,1]=4 399 B11R1.24 O=CCSc1cccc(=O)[nH]1 62a_200015260668_100000752884 [0,0,1,0,0,0|2,0,1]=4 400 B11R1.37 C=Cc1cc(ccc1C=O)Br 271570a_100011290941_100010146562 [0,0,1,0,0,0|3,0,0]=4 401 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [0,0,1,0,0,0|3,0,0]=4 402 B11R1.37 C=Cc1cc(ccc1C=O)F 271570a_100011290941_100000752949 [0,0,1,0,0,0|3,0,0]=4 403 B11R1.37 C=Cc1cc(ccc1C=O)O 271570a_100011290941_100011236494 [0,0,1,0,0,0|2,0,1]=4 404 B11R1.37 C=Cc1ccc(=O)[nH]c1C#N 271570a_100011290941_100010559384 [0,0,1,0,0,0|1,0,1]=3 405 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [0,0,1,0,0,0|3,0,0]=4 406 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [0,0,1,0,0,0|3,0,0]=4 407 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [0,0,1,0,0,0|3,0,0]=4 408 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [0,0,1,0,0,0|3,0,0]=4 409 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [0,0,1,0,0,0|2,0,1]=4 410 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [0,0,1,0,0,0|2,0,1]=4 411 B11R1.37 C=Cc1nc(ccc1C=O)C 271570a_100011290941_100000085379 [0,0,1,0,0,0|2,0,1]=4 412 B11R1.37 C=Cc1nc(ccc1C=O)F 271570a_100011290941_100009846357 [0,0,1,0,0,0|2,0,1]=4 413 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [0,0,1,0,0,0|1,0,2]=4 414 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,0,1,0,0,0|1,0,0]=2 415 B11R1.40 C=CC(=O)Cc1ccccn1 1458a_100000185746_100000721315 [0,0,1,0,0,0|2,0,0]=3 416 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [0,0,1,0,0,0|2,0,0]=3 417 B11R1.40 C=CC(=O)Cc1cccnn1 1458a_100000185746_100016990269 [0,0,1,0,0,0|3,0,0]=4 418 B11R1.40 C=CC(=O)Cc1ccncc1 1458a_100000185746_100000705612 [0,0,1,0,0,0|2,0,0]=3 419 B11R1.40 C=CC(=O)Cc1cnccn1 1458a_100000185746_100016995436 [0,0,1,0,0,0|3,0,0]=4 420 B11R1.40 C=CC(=O)Cc1cncnc1 1458a_100000185746_100015196519 [0,0,1,0,0,0|3,0,0]=4 421 B11R1.40 C=CC(=O)Cc1ncccn1 1458a_100000185746_100000703007 [0,0,1,0,0,0|3,0,0]=4 422 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,0,1,0,0,0|0,0,0]=1 423 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,0,1,0,0,0|0,0,0]=1 424 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [0,0,1,0,0,0|2,0,1]=4 425 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [0,0,1,0,0,0|1,0,2]=4 426 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [0,0,1,0,0,0|0,0,2]=3 427 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [0,0,1,0,0,0|0,0,2]=3 428 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [0,0,1,0,0,0|0,0,2]=3 429 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [0,0,1,0,0,0|0,0,2]=3 430 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [0,0,1,0,0,0|1,0,1]=3 431 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [0,0,1,0,0,0|2,0,1]=4 432 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [0,0,1,0,0,0|1,0,1]=3 433 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [0,0,1,0,0,0|1,0,1]=3 434 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,0,1,0,0,0|2,0,0]=3 435 B11R1.41 C=Cc1ccccc1CC#N 271570a_100011290941_100000033512 [0,0,1,0,0,0|2,0,1]=4 436 B11R1.41 C=Cc1ccccc1CCN 271570a_100011290941_100000747383 [0,0,1,0,0,0|2,0,1]=4 437 B11R1.41 C=Cc1ccccc1CCO 271570a_100011290941_100000731337 [0,0,1,0,0,0|1,0,2]=4 438 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,0,1,0,0,0|3,0,0]=4 439 B11R1.41 C=Cc1ccccc1CNN 271570a_100011290941_200016993956 [0,0,1,0,0,0|3,0,0]=4 440 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,0,1,0,0,0|3,0,0]=4 441 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,0,1,0,0,0|3,0,0]=4 442 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,0,1,0,0,0|3,0,0]=4 443 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,0,1,0,0,0|3,0,0]=4 444 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,0,1,0,0,0|3,0,0]=4 445 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,0,1,0,0,0|3,0,0]=4 446 B11R1.41 C=Cc1ccccc1N=[N+]=[N-] 271570a_100011290941_100000762926 [0,0,1,0,0,0|2,0,1]=4 447 B11R1.41 C=Cc1ccccc1NCC 271570a_100011290941_114873767003 [0,0,1,0,0,0|1,0,1]=3 448 B11R1.41 C=Cc1ccccc1NCC 34a_100012022501_100000210202 [0,0,1,0,0,0|1,0,1]=3 449 B11R1.41 C=Cc1ccccc1NCF 34a_100012022501_100015361967 [0,0,1,0,0,0|1,0,1]=3 450 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,0,1,0,0,0|2,0,1]=4 451 B11R1.41 C=Cc1ccccc1SCC 271570a_100011290941_100000230856 [0,0,1,0,0,0|2,0,1]=4 452 B11R1.41 C=Cc1ccccc1SCC 62a_100000210202_100011218376 [0,0,1,0,0,0|2,0,1]=4 453 B11R1.41 C=Cc1ccccc1SCC 62a_100011218376_100000210202 [0,0,1,0,0,0|2,0,1]=4 454 B11R1.41 C=Cc1ccccc1SCF 62a_100011218376_100015361967 [0,0,1,0,0,0|2,0,1]=4 455 B11R1.41 C=Cc1ccccc1SCF 62a_100015361967_100011218376 [0,0,1,0,0,0|2,0,1]=4 456 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,0,1,0,0,0|3,0,0]=4 457 B11R1.41 CSc1ccccc1NC=O 62a_200000210301_200020615051 [0,0,1,0,0,0|1,0,1]=3 458 B11R1.41 CSc1ccccc1NC=O 62a_200020615051_200000210301 [0,0,1,0,0,0|1,0,1]=3 459 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200020615051_200025704644 [0,0,1,0,0,0|1,0,1]=3 460 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200025704644_200020615051 [0,0,1,0,0,0|1,0,1]=3 461 B11R1.81 C=C=Cc1ccc(=O)[nH]c1N 271570a_100015277604_100009884077 [0,0,1,0,0,0|1,0,1]=3 462 B11R1.81 CC=Cc1ccc(=O)[nH]c1N 271570a_100016259895_100009884077 [0,0,1,0,0,0|1,0,1]=3 463 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,0,1,0,0,0|2,0,1]=4 464 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,0,1,0,0,0|2,0,1]=4 465 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,0,1,0,0,0|1,0,2]=4 466 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,0,1,0,0,0|1,0,2]=4 467 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,0,1,0,0,0|2,0,1]=4 468 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,0,1,0,0,0|2,0,1]=4 469 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,0,1,0,0,0|2,0,1]=4 470 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,0,1,0,0,0|2,0,1]=4 471 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,0,1,0,0,0|2,0,1]=4 472 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,0,1,0,0,0|2,0,1]=4 473 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,0,1,0,0,0|2,0,1]=4 474 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,0,1,0,0,0|2,0,1]=4 475 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,0,1,0,0,0|1,0,1]=3 476 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,0,1,0,0,0|1,0,1]=3 477 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,0,1,0,0,0|0,0,2]=3 478 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,0,1,0,0,0|0,0,2]=3 479 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,0,1,0,0,0|0,0,2]=3 480 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,0,1,0,0,0|0,0,2]=3 481 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,0,1,0,0,0|1,0,1]=3 482 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,0,1,0,0,0|1,0,1]=3 483 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,0,1,0,0,0|1,0,1]=3 484 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,0,1,0,0,0|1,0,1]=3 485 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,0,1,0,0,0|1,0,1]=3 486 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,0,1,0,0,0|1,0,1]=3 487 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,0,1,0,0,0|1,0,1]=3 488 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,0,1,0,0,0|1,0,1]=3 489 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,0,1,0,0,0|1,0,1]=3 490 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,0,1,0,0,0|1,0,1]=3 491 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,0,1,0,0,0|1,0,1]=3 492 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,0,1,0,0,0|1,0,1]=3 493 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,0,1,0,0,0|1,0,1]=3 494 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [0,0,1,0,0,0|2,0,1]=4 495 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,0,1,0,0,0|2,0,1]=4 496 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,0,1,0,0,0|1,0,2]=4 497 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,0,1,0,0,0|3,0,0]=4 498 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,0,1,0,0,0|2,0,0]=3 499 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,0,1,0,0,0|2,0,1]=4 500 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,0,1,0,0,0|2,0,1]=4 501 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,0,1,0,0,0|2,0,1]=4 502 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,0,1,0,0,0|2,0,1]=4 503 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,0,1,0,0,0|2,0,1]=4 504 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [0,0,1,0,0,0|1,0,2]=4 505 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,0,1,0,0,0|1,0,0]=2 506 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [0,0,1,0,0,0|2,0,0]=3 507 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [0,0,1,0,0,0|2,0,0]=3 508 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [0,0,1,0,0,0|2,0,0]=3 509 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [0,0,1,0,0,0|1,0,2]=4 510 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [0,0,1,0,0,0|1,0,2]=4 511 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,0,1,0,0,0|2,0,1]=4 512 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,0,1,0,0,0|2,0,1]=4 513 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,0,1,0,0,0|2,0,1]=4 514 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,0,1,0,0,0|2,0,1]=4 515 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,0,1,0,0,0|2,0,1]=4 516 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,0,1,0,0,0|2,0,1]=4 517 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [0,0,1,0,0,0|3,0,0]=4 518 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [0,0,1,0,0,0|2,0,1]=4 519 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [0,0,1,0,0,0|1,0,2]=4 520 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [0,0,1,0,0,0|1,0,1]=3 521 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,0,1,0,0,0|1,0,1]=3 522 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,0,1,0,0,0|1,0,1]=3 523 B11R1.91 NC(=O)COc1cccnc1 34a_100000210849_100000187820 [0,0,1,0,0,0|2,0,1]=4 524 B11R1.91 NC(=O)COc1cccnc1 7a_100000210849_100000187820 [0,0,1,0,0,0|2,0,1]=4 525 B11R1.91 NC(=O)COc1ccncc1 34a_100000212176_100000187820 [0,0,1,0,0,0|2,0,1]=4 526 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [0,0,1,0,0,0|1,0,1]=3 527 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [0,0,1,0,0,0|1,0,1]=3 528 B11R1.91 NC(=O)CSc1ccccn1 62a_100000747473_100011216584 [0,0,1,0,0,0|2,0,1]=4 529 B11R1.91 NC(=O)CSc1ccccn1 62a_100011216584_100000747473 [0,0,1,0,0,0|2,0,1]=4 530 B11R1.91 NC(=O)CSc1cccnc1 62a_100000210063_100000747473 [0,0,1,0,0,0|2,0,1]=4 531 B11R1.91 NC(=O)CSc1cccnc1 62a_100000747473_100000210063 [0,0,1,0,0,0|2,0,1]=4 532 B11R1.91 NC(=O)CSc1ccncc1 62a_100000728582_100000747473 [0,0,1,0,0,0|2,0,1]=4 533 B11R1.91 NC(=O)CSc1ccncc1 62a_100000747473_100000728582 [0,0,1,0,0,0|2,0,1]=4 534 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [0,0,1,0,0,0|2,0,1]=4 535 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,0,1,0,0,0|2,0,1]=4 536 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [0,0,1,0,0,0|2,0,1]=4 537 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [0,0,1,0,0,0|2,0,1]=4 538 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [0,0,1,0,0,0|1,0,2]=4 539 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,0,1,0,0,0|1,0,0]=2 540 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [0,0,1,0,0,0|2,0,0]=3 541 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [0,0,1,0,0,0|2,0,0]=3 542 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [0,0,1,0,0,0|2,0,0]=3 543 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [0,0,1,0,0,0|1,0,2]=4 544 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,0,1,0,0,0|2,0,1]=4 545 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,0,1,0,0,0|2,0,1]=4 546 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,1,0|2,0,1]=4 547 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [0,0,0,0,1,0|2,0,1]=4 548 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [0,0,0,0,1,0|2,0,1]=4 549 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [0,0,0,0,1,0|2,0,1]=4 550 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [0,0,0,0,1,0|2,0,1]=4 551 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [0,0,0,0,1,0|2,0,1]=4 552 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,0,1,0|1,0,1]=3 553 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [0,0,0,0,1,0|2,0,1]=4 554 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,0,1,0|1,0,1]=3 555 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,1,0|2,0,1]=4 556 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [0,0,0,0,1,0|2,0,1]=4 557 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [0,0,0,0,1,0|2,0,1]=4 558 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [0,0,0,0,1,0|2,0,1]=4 559 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [0,0,0,0,1,0|2,0,1]=4 560 B11R2.1 Oc1ncn2c1cccc2 271570a_203496583355_100000688344 [0,0,0,0,1,0|2,0,1]=4 561 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,0,1,0|0,0,1]=2 562 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,0,1,0|1,0,1]=3 563 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,0,1,0|1,0,1]=3 564 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [0,0,0,0,1,0|1,0,1]=3 565 B11R2.10 Oc1cn2ccccc2n1 271570a_203496583355_100009819586 [0,0,0,0,1,0|1,0,2]=4 566 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [0,0,0,0,1,0|1,0,1]=3 567 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,0,0,0,1,0|1,0,2]=4 568 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [0,0,0,0,1,0|2,0,1]=4 569 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [0,0,0,0,1,0|1,0,2]=4 570 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [0,0,0,0,1,0|1,0,2]=4 571 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [0,0,0,0,1,0|1,0,2]=4 572 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [0,0,0,0,1,0|2,0,1]=4 573 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [0,0,0,0,1,0|1,0,2]=4 574 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [0,0,0,0,1,0|2,0,1]=4 575 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [0,0,0,0,1,0|2,0,1]=4 576 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [0,0,0,0,1,0|2,0,1]=4 577 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [0,0,0,0,1,0|2,0,1]=4 578 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [0,0,0,0,1,0|1,0,2]=4 579 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [0,0,0,0,1,0|2,0,1]=4 580 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [0,0,0,0,1,0|1,0,2]=4 581 B10R1.1 C=C=Cc1ccc(=O)[nH]c1 271570a_100015277604_100000212171 [1,0,1,0,0,0|0,0,1]=3 582 B10R1.1 C=C=Cc1ccc(=O)[nH]n1 271570a_100015277604_100009820020 [1,0,1,0,0,0|1,0,1]=4 583 B10R1.1 C=C=Cc1cnc(=O)[nH]c1 271570a_100015277604_102495366499 [1,0,1,0,0,0|1,0,1]=4 584 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [1,0,1,0,0,0|0,0,1]=3 585 B10R1.1 CC=Cc1ccc(=O)[nH]n1 271570a_100016259895_100009820020 [1,0,1,0,0,0|1,0,1]=4 586 B10R1.1 CC=Cc1cnc(=O)[nH]c1 271570a_100016259895_102495366499 [1,0,1,0,0,0|1,0,1]=4 587 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,0,1,0,0,0|0,0,1]=3 588 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 589 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 590 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,0,1,0,0,0|1,0,1]=4 591 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,0,1,0,0,0|1,0,1]=4 592 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,0,1,0,0,0|1,0,1]=4 593 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [1,0,1,0,0,0|1,0,1]=4 594 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [1,0,1,0,0,0|1,0,1]=4 595 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [1,0,1,0,0,0|1,0,1]=4 596 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [1,0,1,0,0,0|1,0,1]=4 597 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [1,0,1,0,0,0|1,0,1]=4 598 B10R1.4 C=C=Cc1ccc[nH]c1=O 271570a_100015277604_100000050042 [1,0,1,0,0,0|1,0,1]=4 599 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,0,1,0,0,0|1,0,1]=4 600 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,0,1,0,0,0|1,0,1]=4 601 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,0,1,0,0,0|1,0,1]=4 602 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,0,1,0,0,0|1,0,1]=4 603 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,0,1,0,0,0|0,0,1]=3 604 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,0,1,0,0,0|1,0,1]=4 605 B10R1.4 C=C=Cc1cccnc1N 271570a_100015277604_100000045569 [1,0,1,0,0,0|1,0,1]=4 606 B10R1.4 C=C=Cc1ccncc1N 271570a_100015277604_100009815883 [1,0,1,0,0,0|1,0,1]=4 607 B10R1.4 C=C=Cc1cnccc1N 271570a_100015277604_100000047001 [1,0,1,0,0,0|1,0,1]=4 608 B10R1.4 C=C=Cc1ncccc1N 271570a_100015277604_100000688686 [1,0,1,0,0,0|1,0,1]=4 609 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,0,1,0,0,0|1,0,1]=4 610 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [1,0,1,0,0,0|1,0,1]=4 611 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,0,1,0,0,0|1,0,1]=4 612 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,0,1,0,0,0|1,0,1]=4 613 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,0,1,0,0,0|1,0,1]=4 614 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,0,1,0,0,0|1,0,1]=4 615 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,0,1,0,0,0|0,0,1]=3 616 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,0,1,0,0,0|1,0,1]=4 617 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [1,0,1,0,0,0|1,0,1]=4 618 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [1,0,1,0,0,0|1,0,1]=4 619 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [1,0,1,0,0,0|1,0,1]=4 620 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [1,0,1,0,0,0|1,0,1]=4 621 B10R1.10 C=C=Cc1cccc(=O)[nH]1 271570a_100015277604_100000761760 [1,0,1,0,0,0|0,0,1]=3 622 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [1,0,1,0,0,0|0,0,1]=3 623 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [1,0,1,0,0,0|1,0,1]=4 624 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [1,0,1,0,0,0|0,0,0]=2 625 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,0,1,0,0,0|1,0,1]=4 626 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,0,1,0,0,0|1,0,1]=4 627 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,0,1,0,0,0|0,0,2]=4 628 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,0,1,0,0,0|0,0,1]=3 629 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,0,1,0,0,0|0,0,1]=3 630 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [1,0,1,0,0,0|1,0,0]=3 631 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,0,1,0,0,0|0,0,1]=3 632 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,0,1,0,0,0|1,0,1]=4 633 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,0,1,0,0,0|1,0,1]=4 634 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,0,1,0,0,0|1,0,1]=4 635 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,0,1,0,0,0|1,0,1]=4 636 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,0,1,0,0,0|1,0,1]=4 637 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,0,1,0,0,0|1,0,1]=4 638 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,0,1,0,0,0|1,0,0]=3 639 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [1,0,1,0,0,0|1,0,1]=4 640 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [1,0,1,0,0,0|2,0,0]=4 641 B10R1.20 C=Cc1ccncc1C=O 271570a_100011290941_100000050567 [1,0,1,0,0,0|1,0,0]=3 642 B10R1.20 C=Cc1cnccc1C=O 271570a_100011290941_100011934409 [1,0,1,0,0,0|1,0,0]=3 643 B10R1.20 C=Cc1cnccc1NC 271570a_100011290941_100010069531 [1,0,1,0,0,0|1,0,1]=4 644 B10R1.20 C=Cc1cnccc1NN 271570a_100011290941_100013404636 [1,0,1,0,0,0|2,0,0]=4 645 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,0,1,0,0,0|1,0,0]=3 646 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [1,0,1,0,0,0|1,0,1]=4 647 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [1,0,1,0,0,0|1,0,1]=4 648 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [1,0,1,0,0,0|1,0,1]=4 649 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [1,0,1,0,0,0|1,0,1]=4 650 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [1,0,1,0,0,0|1,0,1]=4 651 B10R1.25 C=Cc1ccc(=O)[nH]c1N 271570a_100011290941_100009884077 [1,0,1,0,0,0|1,0,0]=3 652 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,1,0,0,0|1,0,1]=4 653 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,1,0,0,0|0,0,1]=3 654 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,1,0,0,0|0,0,1]=3 655 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,1,0,0,0|0,0,1]=3 656 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,1,0,0,0|0,0,1]=3 657 B12R1.1 C/C=C/COc1ccc(=O)[nH]c1 34a_100000075641_100102629194 [0,1,1,0,0,0|0,0,2]=4 658 B12R1.1 C/C=C/CSc1ccc(=O)[nH]c1 62a_100000212171_100102629194 [0,1,1,0,0,0|0,0,2]=4 659 B12R1.1 C/C=C/CSc1ccc(=O)[nH]c1 62a_100102629194_100000212171 [0,1,1,0,0,0|0,0,2]=4 660 B12R1.1 C=CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000754431 [0,1,1,0,0,0|0,0,2]=4 661 B12R1.1 C=CCCSc1ccc(=O)[nH]c1 62a_100000212171_100000754431 [0,1,1,0,0,0|0,0,2]=4 662 B12R1.1 C=CCCSc1ccc(=O)[nH]c1 62a_100000754431_100000212171 [0,1,1,0,0,0|0,0,2]=4 663 B12R1.1 C=CCOCc1ccc(=O)[nH]c1 34a_100011999846_100015514636 [0,1,1,0,0,0|0,0,2]=4 664 B12R1.1 CC=CCOc1ccc(=O)[nH]c1 34a_100000075641_100000070051 [0,1,1,0,0,0|0,0,2]=4 665 B12R1.1 CC=CCSc1ccc(=O)[nH]c1 62a_100000070051_100000212171 [0,1,1,0,0,0|0,0,2]=4 666 B12R1.1 CC=CCSc1ccc(=O)[nH]c1 62a_100000212171_100000070051 [0,1,1,0,0,0|0,0,2]=4 667 B12R1.1 CCCC=Cc1ccc(=O)[nH]c1 271570a_100016258520_100000212171 [0,1,1,0,0,0|0,0,2]=4 668 B12R1.1 CCOC=Cc1ccc(=O)[nH]c1 271570a_100016256518_100000212171 [0,1,1,0,0,0|0,0,2]=4 669 B12R1.1 COCC=Cc1ccc(=O)[nH]c1 271570a_100016286323_100000212171 [0,1,1,0,0,0|0,0,2]=4 670 B12R1.21 C=C(C)COc1ccc(=O)[nH]c1 34a_100000075641_100000748629 [0,1,1,0,0,0|1,0,1]=4 671 B12R1.21 C=C(C)CSc1ccc(=O)[nH]c1 62a_100000212171_100000211660 [0,1,1,0,0,0|1,0,1]=4 672 B12R1.21 C=C(C)CSc1ccc(=O)[nH]c1 62a_100000748629_100000212171 [0,1,1,0,0,0|1,0,1]=4 673 B12R1.21 C=C(F)COc1ccc(=O)[nH]c1 34a_100000075641_100009893438 [0,1,1,0,0,0|1,0,1]=4 674 B12R1.21 C=C(F)CSc1ccc(=O)[nH]c1 62a_100000042424_100000212171 [0,1,1,0,0,0|1,0,1]=4 675 B12R1.21 C=C(F)CSc1ccc(=O)[nH]c1 62a_100000212171_100000042424 [0,1,1,0,0,0|1,0,1]=4 676 B12R1.21 CC(C)C=Cc1ccc(=O)[nH]c1 271570a_100016257149_100000212171 [0,1,1,0,0,0|0,0,2]=4 677 B12R1.21 CC(O)C=Cc1ccc(=O)[nH]c1 271570a_200011019289_100000212171 [0,1,1,0,0,0|0,0,2]=4 678 B12R1.49 C=CC(C)Sc1ccc(=O)[nH]c1 62a_100011215867_100000212171 [0,1,1,0,0,0|1,0,1]=4 679 B12R1.69 C=CCSc1c[nH]c(=O)cc1F 62a_100000210623_100015631685 [0,1,1,0,0,0|1,0,1]=4 680 B12R1.69 C=CCSc1c[nH]c(=O)cc1F 62a_100015631685_100000210623 [0,1,1,0,0,0|1,0,1]=4 681 B12R1.69 C=CCSc1ccc(=O)[nH]c1N 62a_100009884077_100000210623 [0,1,1,0,0,0|1,0,1]=4 682 B12R1.385 C=CCSc1c[nH]c(=O)c(c1)Br 62a_100000210623_100010125443 [0,1,1,0,0,0|1,0,1]=4 683 B12R1.385 C=CCSc1c[nH]c(=O)c(c1)Br 62a_100010125443_100000210623 [0,1,1,0,0,0|1,0,1]=4 684 B12R1.385 C=CCSc1c[nH]c(=O)c(c1)F 62a_100000210623_100000723523 [0,1,1,0,0,0|1,0,1]=4 685 B12R1.385 C=CCSc1c[nH]c(=O)c(c1)F 62a_100000723523_100000210623 [0,1,1,0,0,0|1,0,1]=4 686 B12R1.385 C=CCSc1c[nH]c(=O)c(c1)O 62a_100000210623_100009814561 [0,1,1,0,0,0|1,0,1]=4 687 B12R1.385 C=CCSc1ccc(=O)n(c1)C 62a_100000210623_100011245003 [0,1,1,0,0,0|1,0,1]=4 688 B12R1.385 C=CCSc1ccc(=O)n(c1)C 62a_100011245003_100000210623 [0,1,1,0,0,0|1,0,1]=4 689 B12R1.25 Cc1cccc(c1N)OCC=O 34a_100000743429_200009817547 [0,1,1,0,0,0|1,0,1]=4 690 B12R1.25 Cc1cccc(c1N)OCC=O 7a_100000743429_200015260668 [0,1,1,0,0,0|1,0,1]=4 691 B12R1.25 Cc1cccc(c1N)SCC=O 62a_100011834072_200015260668 [0,1,1,0,0,0|1,0,1]=4 692 B12R1.25 Cc1cccc(c1N)SCC=O 62a_200015260668_100011834072 [0,1,1,0,0,0|1,0,1]=4 693 B12R1.25 Nc1c(cccc1OCC=O)Br 34a_100011934926_200009817547 [0,1,1,0,0,0|1,0,1]=4 694 B12R1.25 Nc1c(cccc1OCC=O)Br 7a_100011934926_200015260668 [0,1,1,0,0,0|1,0,1]=4 695 B12R1.25 Nc1c(cccc1OCC=O)Cl 34a_100012022510_200009817547 [0,1,1,0,0,0|1,0,1]=4 696 B12R1.25 Nc1c(cccc1OCC=O)Cl 7a_100012022510_200015260668 [0,1,1,0,0,0|1,0,1]=4 697 B12R1.25 Nc1c(cccc1OCC=O)F 34a_100020591140_200009817547 [0,1,1,0,0,0|1,0,1]=4 698 B12R1.25 Nc1c(cccc1OCC=O)F 7a_100020591140_200015260668 [0,1,1,0,0,0|1,0,1]=4 699 B12R1.25 Nc1c(cccc1OCC=O)I 34a_200000049512_200009817547 [0,1,1,0,0,0|1,0,1]=4 700 B12R1.25 Nc1c(cccc1OCC=O)I 7a_200000049512_200015260668 [0,1,1,0,0,0|1,0,1]=4 701 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_100010146558_200015260668 [0,1,1,0,0,0|1,0,1]=4 702 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_200015260668_100010146558 [0,1,1,0,0,0|1,0,1]=4 703 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_100010190421_200015260668 [0,1,1,0,0,0|1,0,1]=4 704 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_200015260668_100010190421 [0,1,1,0,0,0|1,0,1]=4 705 B12R1.25 Nc1c(cccc1SCC=O)F 62a_100000042321_200015260668 [0,1,1,0,0,0|1,0,1]=4 706 B12R1.25 Nc1c(cccc1SCC=O)F 62a_200015260668_100000042321 [0,1,1,0,0,0|1,0,1]=4 707 B12R1.25 Nc1c(cccc1SCC=O)O 62a_200015260668_100011934926 [0,1,1,0,0,0|1,0,1]=4 708 B12R1.25 Nc1cccc(c1N)OCC=O 34a_100000033209_200009817547 [0,1,1,0,0,0|1,0,1]=4 709 B12R1.25 Nc1cccc(c1N)SCC=O 62a_100015191791_200015260668 [0,1,1,0,0,0|1,0,1]=4 710 B12R1.121 CNc1ccccc1OCC=O 34a_100000033821_200009817547 [0,1,1,0,0,0|1,0,1]=4 711 B12R1.121 CNc1ccccc1SCC=O 62a_100020606079_200015260668 [0,1,1,0,0,0|1,0,1]=4 712 B12R1.121 CNc1ccccc1SCC=O 62a_200015260668_100020606079 [0,1,1,0,0,0|1,0,1]=4 713 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200000210301_200016268969 [0,1,1,0,0,0|1,0,0]=3 714 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200016268969_200000210301 [0,1,1,0,0,0|1,0,0]=3 715 B12R1.121 NCc1ccccc1OCC=O 34a_100000185550_200009817547 [0,1,1,0,0,0|1,0,1]=4 716 B12R1.121 NCc1ccccc1SCC=O 62a_100000689332_200015260668 [0,1,1,0,0,0|1,0,1]=4 717 B12R1.121 NCc1ccccc1SCC=O 62a_200015260668_100000689332 [0,1,1,0,0,0|1,0,1]=4 718 B12R1.121 NNc1ccccc1SCC=O 62a_100000241748_200015260668 [0,1,1,0,0,0|1,0,1]=4 719 B12R1.121 NNc1ccccc1SCC=O 62a_200015260668_100000241748 [0,1,1,0,0,0|1,0,1]=4 720 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200016268969_200025704644 [0,1,1,0,0,0|1,0,0]=3 721 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200025704644_200016268969 [0,1,1,0,0,0|1,0,0]=3 722 B12R1.125 CC(=O)C=Cc1ccccc1Br 1458a_100000719032_200000210301 [0,1,1,0,0,0|1,0,0]=3 723 B12R1.125 CC(=O)C=Cc1ccccc1Cl 1458a_100000720304_200000210301 [0,1,1,0,0,0|1,0,0]=3 724 B12R1.125 CC(=O)C=Cc1ccccc1F 1458a_100016256065_200000210301 [0,1,1,0,0,0|1,0,0]=3 725 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,1,1,0,0,0|1,0,0]=3 726 B12R1.125 CC(C)C=Cc1ccccc1N 271570a_100016257149_100000210017 [0,1,1,0,0,0|1,0,1]=4 727 B12R1.125 CC(O)C=Cc1ccccc1N 271570a_200011019289_100000210017 [0,1,1,0,0,0|0,0,2]=4 728 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [0,1,1,0,0,0|1,0,1]=4 729 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [0,1,1,0,0,0|1,0,1]=4 730 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000210017_100000747473 [0,1,1,0,0,0|1,0,1]=4 731 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000747473_100000210017 [0,1,1,0,0,0|1,0,1]=4 732 B12R1.125 Nc1ccccc1OCC(=O)[O-] 34a_100000185747_100020667443 [0,1,1,0,0,0|1,0,1]=4 733 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100000210017_100020667443 [0,1,1,0,0,0|1,0,1]=4 734 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210017 [0,1,1,0,0,0|1,0,1]=4 735 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Br 1458a_100000719032_200025704644 [0,1,1,0,0,0|1,0,0]=3 736 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Cl 1458a_100000720304_200025704644 [0,1,1,0,0,0|1,0,0]=3 737 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1F 1458a_100016256065_200025704644 [0,1,1,0,0,0|1,0,0]=3 738 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,1,1,0,0,0|1,0,0]=3 739 B12R1.267 C/C=C/COc1ccccc1N 34a_100000185747_100102629194 [0,1,1,0,0,0|1,0,1]=4 740 B12R1.267 C/C=C/COc1ccccc1N 7a_100000185747_100102629194 [0,1,1,0,0,0|1,0,1]=4 741 B12R1.267 C/C=C/CSc1ccccc1N 62a_100000210017_100102629194 [0,1,1,0,0,0|1,0,1]=4 742 B12R1.267 C/C=C/CSc1ccccc1N 62a_100102629194_100000210017 [0,1,1,0,0,0|1,0,1]=4 743 B12R1.267 CC=CCOc1ccccc1N 34a_100000185747_100000070051 [0,1,1,0,0,0|1,0,1]=4 744 B12R1.267 CC=CCOc1ccccc1N 7a_100000185747_100000070051 [0,1,1,0,0,0|1,0,1]=4 745 B12R1.267 CC=CCSc1ccccc1N 62a_100000070051_100000210017 [0,1,1,0,0,0|1,0,1]=4 746 B12R1.267 CC=CCSc1ccccc1N 62a_100000210017_100000070051 [0,1,1,0,0,0|1,0,1]=4 747 B12R1.267 CCCC=Cc1ccccc1N 271570a_100016258520_100000210017 [0,1,1,0,0,0|1,0,1]=4 748 B12R1.267 CCOC=Cc1ccccc1N 271570a_100016256518_100000210017 [0,1,1,0,0,0|1,0,1]=4 749 B12R1.267 COCC=Cc1ccccc1N 271570a_100016286323_100000210017 [0,1,1,0,0,0|0,0,2]=4 750 B12R1.267 Nc1ccccc1COCC=O 34a_100000212039_200009817547 [0,1,1,0,0,0|0,0,2]=4 751 B12R1.374 Cc1ccc(c(c1)OCC=O)N 34a_100000211527_200009817547 [0,1,1,0,0,0|1,0,1]=4 752 B12R1.374 Cc1ccc(c(c1)OCC=O)N 7a_100000211527_200015260668 [0,1,1,0,0,0|1,0,1]=4 753 B12R1.374 Cc1ccc(c(c1)SCC=O)N 62a_100011356834_200015260668 [0,1,1,0,0,0|1,0,1]=4 754 B12R1.374 Cc1ccc(c(c1)SCC=O)N 62a_200015260668_100011356834 [0,1,1,0,0,0|1,0,1]=4 755 B12R1.374 Nc1ccc(c(c1)OCC=O)N 34a_100025717382_200009817547 [0,1,1,0,0,0|1,0,1]=4 756 B12R1.374 Nc1ccc(c(c1)SCC=O)N 62a_100011534242_200015260668 [0,1,1,0,0,0|1,0,1]=4 757 B12R1.374 Nc1ccc(c(c1)SCC=O)N 62a_200015260668_100011534242 [0,1,1,0,0,0|1,0,1]=4 758 B12R1.374 Nc1ccc(cc1OCC=O)Br 34a_100000739049_200009817547 [0,1,1,0,0,0|1,0,1]=4 759 B12R1.374 Nc1ccc(cc1OCC=O)Br 7a_100000739049_200015260668 [0,1,1,0,0,0|1,0,1]=4 760 B12R1.374 Nc1ccc(cc1OCC=O)Cl 34a_100000185728_200009817547 [0,1,1,0,0,0|1,0,1]=4 761 B12R1.374 Nc1ccc(cc1OCC=O)Cl 7a_100000185728_200015260668 [0,1,1,0,0,0|1,0,1]=4 762 B12R1.374 Nc1ccc(cc1OCC=O)F 34a_100000753323_200009817547 [0,1,1,0,0,0|1,0,1]=4 763 B12R1.374 Nc1ccc(cc1OCC=O)F 7a_100000753323_200015260668 [0,1,1,0,0,0|1,0,1]=4 764 B12R1.374 Nc1ccc(cc1OCC=O)I 34a_100000057187_200009817547 [0,1,1,0,0,0|1,0,1]=4 765 B12R1.374 Nc1ccc(cc1OCC=O)I 7a_100000057187_200015260668 [0,1,1,0,0,0|1,0,1]=4 766 B12R1.374 Nc1ccc(cc1SCC=O)Br 62a_100000187925_200015260668 [0,1,1,0,0,0|1,0,1]=4 767 B12R1.374 Nc1ccc(cc1SCC=O)Br 62a_200015260668_100000187925 [0,1,1,0,0,0|1,0,1]=4 768 B12R1.374 Nc1ccc(cc1SCC=O)Cl 62a_100000761889_200015260668 [0,1,1,0,0,0|1,0,1]=4 769 B12R1.374 Nc1ccc(cc1SCC=O)Cl 62a_200015260668_100000761889 [0,1,1,0,0,0|1,0,1]=4 770 B12R1.374 Nc1ccc(cc1SCC=O)F 62a_100000760547_200015260668 [0,1,1,0,0,0|1,0,1]=4 771 B12R1.374 Nc1ccc(cc1SCC=O)F 62a_200015260668_100000760547 [0,1,1,0,0,0|1,0,1]=4 772 B12R1.374 Nc1ccc(cc1SCC=O)O 62a_100012001276_200015260668 [0,1,1,0,0,0|1,0,1]=4 773 B12R1.374 Nc1ccc(cc1SCC=O)O 62a_200015260668_100012001276 [0,1,1,0,0,0|1,0,1]=4 774 B12R1.1631 Cc1cccc(c1OCC=O)N 34a_100000756359_200009817547 [0,1,1,0,0,0|1,0,1]=4 775 B12R1.1631 Cc1cccc(c1OCC=O)N 7a_100000756359_200015260668 [0,1,1,0,0,0|1,0,1]=4 776 B12R1.1631 Cc1cccc(c1SCC=O)N 62a_100000684715_200015260668 [0,1,1,0,0,0|1,0,1]=4 777 B12R1.1631 Cc1cccc(c1SCC=O)N 62a_200015260668_100000684715 [0,1,1,0,0,0|1,0,1]=4 778 B12R1.1631 Nc1cccc(c1OCC=O)Br 34a_100011934915_200009817547 [0,1,1,0,0,0|1,0,1]=4 779 B12R1.1631 Nc1cccc(c1OCC=O)Cl 34a_100000754742_200009817547 [0,1,1,0,0,0|1,0,1]=4 780 B12R1.1631 Nc1cccc(c1OCC=O)F 34a_100011934987_200009817547 [0,1,1,0,0,0|1,0,1]=4 781 B12R1.1631 Nc1cccc(c1OCC=O)I 34a_100010084371_200009817547 [0,1,1,0,0,0|1,0,1]=4 782 B12R1.1631 Nc1cccc(c1OCC=O)N 34a_200016994477_200009817547 [0,1,1,0,0,0|1,0,1]=4 783 B12R1.1631 Nc1cccc(c1SCC=O)Br 62a_100020590159_200015260668 [0,1,1,0,0,0|1,0,1]=4 784 B12R1.1631 Nc1cccc(c1SCC=O)Br 62a_200015260668_100020590159 [0,1,1,0,0,0|1,0,1]=4 785 B12R1.1631 Nc1cccc(c1SCC=O)Cl 62a_100000049713_200015260668 [0,1,1,0,0,0|1,0,1]=4 786 B12R1.1631 Nc1cccc(c1SCC=O)Cl 62a_200015260668_100000049713 [0,1,1,0,0,0|1,0,1]=4 787 B12R1.1631 Nc1cccc(c1SCC=O)F 62a_100000690935_200015260668 [0,1,1,0,0,0|1,0,1]=4 788 B12R1.1631 Nc1cccc(c1SCC=O)F 62a_200015260668_100000690935 [0,1,1,0,0,0|1,0,1]=4 789 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_100012183704_200015260668 [0,1,1,0,0,0|1,0,1]=4 790 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_200015260668_100012183704 [0,1,1,0,0,0|1,0,1]=4 791 B12R1.28 C/C=C/COc1cccc(=O)[nH]1 34a_100000033347_100102629194 [0,1,1,0,0,0|0,0,2]=4 792 B12R1.28 C/C=C/CSc1cccc(=O)[nH]1 62a_100102629194_100000752884 [0,1,1,0,0,0|0,0,2]=4 793 B12R1.28 C=CCCOc1cccc(=O)[nH]1 34a_100000033347_100000754431 [0,1,1,0,0,0|0,0,2]=4 794 B12R1.28 C=CCCSc1cccc(=O)[nH]1 62a_100000754431_100000752884 [0,1,1,0,0,0|0,0,2]=4 795 B12R1.28 C=CCNCc1cccc(=O)[nH]1 2230a_100000696482_100000210623 [0,1,1,0,0,0|0,0,2]=4 796 B12R1.28 CC=CCOc1cccc(=O)[nH]1 34a_100000033347_100000070051 [0,1,1,0,0,0|0,0,2]=4 797 B12R1.28 CC=CCSc1cccc(=O)[nH]1 62a_100000070051_100000752884 [0,1,1,0,0,0|0,0,2]=4 798 B12R1.28 CCCC=Cc1cccc(=O)[nH]1 271570a_100016258520_100000761760 [0,1,1,0,0,0|0,0,2]=4 799 B12R1.28 CCOC=Cc1cccc(=O)[nH]1 271570a_100016256518_100000761760 [0,1,1,0,0,0|0,0,2]=4 800 B12R1.28 COCC=Cc1cccc(=O)[nH]1 271570a_100016286323_100000761760 [0,1,1,0,0,0|0,0,2]=4 801 B12R1.50 C=CC(C)Sc1cccc(=O)[nH]1 62a_100011215867_100000752884 [0,1,1,0,0,0|1,0,1]=4 802 B12R1.226 C=C(C)COc1cccc(=O)[nH]1 34a_100000033347_100000748629 [0,1,1,0,0,0|1,0,1]=4 803 B12R1.226 C=C(C)CSc1cccc(=O)[nH]1 62a_100000748629_100000752884 [0,1,1,0,0,0|1,0,1]=4 804 B12R1.226 C=C(F)COc1cccc(=O)[nH]1 34a_100000033347_100009893438 [0,1,1,0,0,0|1,0,1]=4 805 B12R1.226 C=C(F)CSc1cccc(=O)[nH]1 62a_100000042424_100000752884 [0,1,1,0,0,0|1,0,1]=4 806 B12R1.226 CC(C)C=Cc1cccc(=O)[nH]1 271570a_100016257149_100000761760 [0,1,1,0,0,0|0,0,2]=4 807 B12R1.226 CC(O)C=Cc1cccc(=O)[nH]1 271570a_200011019289_100000761760 [0,1,1,0,0,0|0,0,2]=4 808 B12R1.57 C=C(C)c1ccc(=O)[nH]c1C#N 271570a_100000694244_100010559384 [0,1,1,0,0,0|1,0,1]=4 809 B12R1.78 C=Cc1cc(ccc1C=O)C=O 271570a_100011290941_100015597013 [0,1,1,0,0,0|2,0,0]=4 810 B12R1.112 C=C=Cc1ccc(=O)[nH]c1C#N 271570a_100015277604_100010559384 [0,1,1,0,0,0|1,0,1]=4 811 B12R1.112 CC=Cc1ccc(=O)[nH]c1C#N 271570a_100016259895_100010559384 [0,1,1,0,0,0|1,0,1]=4 812 B12R1.32 C#CCC(=O)Nc1ccccc1 1626a_100000106764_100011220946 [0,1,1,0,0,0|0,0,2]=4 813 B12R1.32 C#CCC(=O)Nc1ccccc1 527a_100000106764_100011220946 [0,1,1,0,0,0|0,0,2]=4 814 B12R1.32 C=CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210623 [0,1,1,0,0,0|2,0,0]=4 815 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [0,1,1,0,0,0|1,0,0]=3 816 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000210193_100000721315 [0,1,1,0,0,0|2,0,0]=4 817 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000233486_100000210623 [0,1,1,0,0,0|2,0,0]=4 818 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000210193_100000733263 [0,1,1,0,0,0|2,0,0]=4 819 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000737805_100000210623 [0,1,1,0,0,0|2,0,0]=4 820 B12R1.32 C=CCC(=O)Cc1ccncc1 1458a_100000210193_100000705612 [0,1,1,0,0,0|2,0,0]=4 821 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [0,1,1,0,0,0|0,0,0]=2 822 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [0,1,1,0,0,0|0,0,0]=2 823 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [0,1,1,0,0,0|0,0,0]=2 824 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [0,1,1,0,0,0|0,0,0]=2 825 B12R1.32 CC#CC(=O)Nc1ccccc1 22a_100000106764_100000763181 [0,1,1,0,0,0|0,0,2]=4 826 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [0,1,1,0,0,0|1,0,0]=3 827 B12R1.32 CC=CC(=O)Cc1ccccn1 1458a_100000210699_100000721315 [0,1,1,0,0,0|2,0,0]=4 828 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,1,1,0,0,0|2,0,0]=4 829 B12R1.32 CC=CC(=O)Cc1ccncc1 1458a_100000210699_100000705612 [0,1,1,0,0,0|2,0,0]=4 830 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [0,1,1,0,0,0|0,0,0]=2 831 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [0,1,1,0,0,0|0,0,0]=2 832 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [0,1,1,0,0,0|0,0,0]=2 833 B12R1.32 CCCC(=O)Nc1ccccc1 11a_100000106764_100000211992 [0,1,1,0,0,0|0,0,2]=4 834 B12R1.32 CCCC(=O)Nc1ccccc1 1626a_100000106764_100000211992 [0,1,1,0,0,0|0,0,2]=4 835 B12R1.32 CCCC(=O)Nc1ccccc1 22a_100000106764_100000211992 [0,1,1,0,0,0|0,0,2]=4 836 B12R1.32 CCCC(=O)Nc1ccccc1 527a_100000106764_100000211992 [0,1,1,0,0,0|0,0,2]=4 837 B12R1.32 CCNC(=O)Nc1ccccc1 2430a_100000106764_100015525214 [0,1,1,0,0,0|0,0,2]=4 838 B12R1.32 CNCC(=O)Nc1ccccc1 2230a_106832991635_100000182850 [0,1,1,0,0,0|0,0,2]=4 839 B12R1.32 CNCC(=O)Nc1ccccc1 34a_100102657272_100000182850 [0,1,1,0,0,0|0,0,2]=4 840 B12R1.32 CNCC(=O)Nc1ccccc1 7a_106832991635_100000182850 [0,1,1,0,0,0|0,0,2]=4 841 B12R1.32 COCC(=O)Nc1ccccc1 11a_100000106764_100000210968 [0,1,1,0,0,0|0,0,2]=4 842 B12R1.32 COCC(=O)Nc1ccccc1 1626a_100000106764_100000210968 [0,1,1,0,0,0|0,0,2]=4 843 B12R1.32 COCC(=O)Nc1ccccc1 22a_100000106764_100000210968 [0,1,1,0,0,0|0,0,2]=4 844 B12R1.32 COCC(=O)Nc1ccccc1 34a_100000246334_200000210301 [0,1,1,0,0,0|0,0,2]=4 845 B12R1.32 COCC(=O)Nc1ccccc1 34a_100138415774_100000182850 [0,1,1,0,0,0|0,0,2]=4 846 B12R1.32 COCC(=O)Nc1ccccc1 527a_100000106764_100000210968 [0,1,1,0,0,0|0,0,2]=4 847 B12R1.32 CSCC(=O)Nc1ccccc1 11a_100000106764_100000184570 [0,1,1,0,0,0|0,0,2]=4 848 B12R1.32 CSCC(=O)Nc1ccccc1 1626a_100000106764_100000184570 [0,1,1,0,0,0|0,0,2]=4 849 B12R1.32 CSCC(=O)Nc1ccccc1 22a_100000106764_100000184570 [0,1,1,0,0,0|0,0,2]=4 850 B12R1.32 CSCC(=O)Nc1ccccc1 527a_100000106764_100000184570 [0,1,1,0,0,0|0,0,2]=4 851 B12R1.32 CSCC(=O)Nc1ccccc1 62a_100012148978_200000210301 [0,1,1,0,0,0|0,0,2]=4 852 B12R1.32 CSCC(=O)Nc1ccccc1 62a_200000210301_100000182850 [0,1,1,0,0,0|0,0,2]=4 853 B12R1.32 N#CCC(=O)Nc1ccccc1 1626a_100000106764_100051588842 [0,1,1,0,0,0|0,0,2]=4 854 B12R1.32 N#CCC(=O)Nc1ccccc1 22a_100000106764_100051588842 [0,1,1,0,0,0|0,0,2]=4 855 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [0,1,1,0,0,0|1,0,0]=3 856 B12R1.32 O=C(C=CBr)Cc1ccccn1 1458a_100016273825_100000721315 [0,1,1,0,0,0|2,0,0]=4 857 B12R1.32 O=C(C=CBr)Cc1cccnc1 1458a_100016273825_100000733263 [0,1,1,0,0,0|2,0,0]=4 858 B12R1.32 O=C(C=CBr)Cc1ccncc1 1458a_100016273825_100000705612 [0,1,1,0,0,0|2,0,0]=4 859 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [0,1,1,0,0,0|0,0,0]=2 860 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [0,1,1,0,0,0|1,0,0]=3 861 B12R1.32 O=C(C=CCl)Cc1ccccn1 1458a_200016279998_100000721315 [0,1,1,0,0,0|2,0,0]=4 862 B12R1.32 O=C(C=CCl)Cc1cccnc1 1458a_200016279998_100000733263 [0,1,1,0,0,0|2,0,0]=4 863 B12R1.32 O=C(C=CCl)Cc1ccncc1 1458a_200016279998_100000705612 [0,1,1,0,0,0|2,0,0]=4 864 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [0,1,1,0,0,0|0,0,0]=2 865 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [0,1,1,0,0,0|0,0,0]=2 866 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [0,1,1,0,0,0|1,0,0]=3 867 B12R1.32 O=C(C=CI)Cc1ccccn1 1458a_100016256311_100000721315 [0,1,1,0,0,0|2,0,0]=4 868 B12R1.32 O=C(C=CI)Cc1cccnc1 1458a_100016256311_100000733263 [0,1,1,0,0,0|2,0,0]=4 869 B12R1.32 O=C(C=CI)Cc1ccncc1 1458a_100016256311_100000705612 [0,1,1,0,0,0|2,0,0]=4 870 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [0,1,1,0,0,0|0,0,0]=2 871 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [0,1,1,0,0,0|0,0,2]=4 872 B12R1.32 [13CH3]OCC(=O)Nc1ccccc1 34a_100000246334_200025704644 [0,1,1,0,0,0|0,0,2]=4 873 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_100012148978_200025704644 [0,1,1,0,0,0|0,0,2]=4 874 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_200025704644_100000182850 [0,1,1,0,0,0|0,0,2]=4 875 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [0,1,1,0,0,0|1,0,0]=3 876 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [0,1,1,0,0,0|0,0,0]=2 877 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [0,1,1,0,0,0|0,0,0]=2 878 B12R1.34 C=CC(C)N(C)c1ccccc1 269982a_100000210012_100011215867 [0,1,1,0,0,0|1,0,1]=4 879 B12R1.34 CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210414 [0,1,1,0,0,0|0,0,2]=4 880 B12R1.34 CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210414 [0,1,1,0,0,0|0,0,2]=4 881 B12R1.34 CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210414 [0,1,1,0,0,0|0,0,2]=4 882 B12R1.34 CN(C(=O)CO)c1ccccc1 22a_100000210012_100000210174 [0,1,1,0,0,0|1,0,1]=4 883 B12R1.34 CNC(=O)N(C)c1ccccc1 512a_106832991638_100000210012 [0,1,1,0,0,0|1,0,1]=4 884 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [0,1,1,0,0,0|0,0,0]=2 885 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [0,1,1,0,0,0|0,0,0]=2 886 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [0,1,1,0,0,0|1,0,0]=3 887 B12R1.43 C=C(C)C(=O)Cc1ccccn1 1458a_100000185857_100000721315 [0,1,1,0,0,0|2,0,0]=4 888 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [0,1,1,0,0,0|2,0,0]=4 889 B12R1.43 C=C(C)C(=O)Cc1ccncc1 1458a_100000185857_100000705612 [0,1,1,0,0,0|2,0,0]=4 890 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [0,1,1,0,0,0|0,0,0]=2 891 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [0,1,1,0,0,0|0,0,0]=2 892 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [0,1,1,0,0,0|0,0,0]=2 893 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [0,1,1,0,0,0|0,0,0]=2 894 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [0,1,1,0,0,0|0,0,0]=2 895 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [0,1,1,0,0,0|0,0,0]=2 896 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [0,1,1,0,0,0|0,0,0]=2 897 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [0,1,1,0,0,0|0,0,0]=2 898 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [0,1,1,0,0,0|0,0,0]=2 899 B12R1.43 CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_200000210301 [0,1,1,0,0,0|0,0,1]=3 900 B12R1.43 CC(C)C(=O)Nc1ccccc1 11a_100000106764_100000210198 [0,1,1,0,0,0|0,0,2]=4 901 B12R1.43 CC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000210198 [0,1,1,0,0,0|0,0,2]=4 902 B12R1.43 CC(C)C(=O)Nc1ccccc1 22a_100000106764_100000210198 [0,1,1,0,0,0|0,0,2]=4 903 B12R1.43 CC(C)C(=O)Nc1ccccc1 527a_100000106764_100000210198 [0,1,1,0,0,0|0,0,2]=4 904 B12R1.43 CC(F)C(=O)Nc1ccccc1 11a_100000106764_100000062450 [0,1,1,0,0,0|0,0,2]=4 905 B12R1.43 CC(F)C(=O)Nc1ccccc1 1626a_100000106764_100000062450 [0,1,1,0,0,0|0,0,2]=4 906 B12R1.43 CC(F)C(=O)Nc1ccccc1 22a_100000106764_100000062450 [0,1,1,0,0,0|0,0,2]=4 907 B12R1.43 CC(F)C(=O)Nc1ccccc1 527a_100000106764_100000062450 [0,1,1,0,0,0|0,0,2]=4 908 B12R1.43 CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100102631434 [0,1,1,0,0,0|1,0,1]=4 909 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 22a_100000106764_100000717761 [0,1,1,0,0,0|0,0,2]=4 910 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 1626a_100000106764_217856618621 [0,1,1,0,0,0|0,0,2]=4 911 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_217856618621 [0,1,1,0,0,0|0,0,2]=4 912 B12R1.43 NC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011215815 [0,1,1,0,0,0|1,0,0]=3 913 B12R1.43 O=C(Nc1ccccc1)C(F)F 11a_100000106764_100000210393 [0,1,1,0,0,0|1,0,1]=4 914 B12R1.43 O=C(Nc1ccccc1)C(F)F 1626a_100000106764_100000210393 [0,1,1,0,0,0|1,0,1]=4 915 B12R1.43 O=C(Nc1ccccc1)C(F)F 22a_100000106764_100000210393 [0,1,1,0,0,0|1,0,1]=4 916 B12R1.43 O=C(Nc1ccccc1)C(F)F 527a_100000106764_100000210393 [0,1,1,0,0,0|1,0,1]=4 917 B12R1.43 O=C(Nc1ccccc1)C(O)O 22a_100000106764_100000233687 [0,1,1,0,0,0|1,0,1]=4 918 B12R1.43 [13CH3]C(=O)C(=O)Nc1ccccc1 1458a_100000738435_200025704644 [0,1,1,0,0,0|0,0,1]=3 919 B12R1.118 O=CC(C=O)Nc1ccccc1 34a_100000106764_100000736813 [0,1,1,0,0,0|1,0,1]=4 920 B12R1.75 C#Cc1ccccc1NC(=O)C 11a_100011470550_100015343762 [0,1,1,0,0,0|0,0,2]=4 921 B12R1.75 C#Cc1ccccc1NC(=O)C 1626a_100011470550_100015343762 [0,1,1,0,0,0|0,0,2]=4 922 B12R1.75 C#Cc1ccccc1NC(=O)C 22a_100011470550_100000070787 [0,1,1,0,0,0|0,0,2]=4 923 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,1,1,0,0,0|1,0,0]=3 924 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [0,1,1,0,0,0|1,0,0]=3 925 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [0,1,1,0,0,0|0,0,0]=2 926 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [0,1,1,0,0,0|0,0,0]=2 927 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [0,1,1,0,0,0|0,0,0]=2 928 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [0,1,1,0,0,0|0,0,0]=2 929 B12R1.75 C=Cc1ccccc1NC(=O)N 271570a_100011290941_100000742221 [0,1,1,0,0,0|0,0,0]=2 930 B12R1.75 C=Cc1ccccc1NC(C)C 271570a_100011290941_100000219599 [0,1,1,0,0,0|1,0,1]=4 931 B12R1.75 C=Cc1ccccc1NC(C)C 34a_100012022501_100000210206 [0,1,1,0,0,0|1,0,1]=4 932 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [0,1,1,0,0,0|1,0,0]=3 933 B12R1.75 C=Cc1cnccc1NC(=O)C 271570a_100011290941_100016132053 [0,1,1,0,0,0|1,0,0]=3 934 B12R1.75 C=Cc1ncccc1OC(=O)C 271570a_100011290941_200009815371 [0,1,1,0,0,0|2,0,0]=4 935 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [0,1,1,0,0,0|2,0,0]=4 936 B12R1.75 CC(=O)Nc1ccccc1C#N 11a_100000211148_100015343762 [0,1,1,0,0,0|1,0,1]=4 937 B12R1.75 CC(=O)Nc1ccccc1C#N 1626a_100000211148_100015343762 [0,1,1,0,0,0|1,0,1]=4 938 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [0,1,1,0,0,0|1,0,1]=4 939 B12R1.75 CC(=O)Nc1ccccc1N[13CH3] 34a_100011193560_200025704644 [0,1,1,0,0,0|1,0,1]=4 940 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 34a_100000185124_200025704644 [0,1,1,0,0,0|1,0,1]=4 941 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 7a_100000185124_200025704644 [0,1,1,0,0,0|1,0,1]=4 942 B12R1.75 CC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000153524 [0,1,1,0,0,0|1,0,1]=4 943 B12R1.75 CCc1ccccc1NC(=O)C 11a_100000212081_100015343762 [0,1,1,0,0,0|0,0,2]=4 944 B12R1.75 CCc1ccccc1NC(=O)C 1626a_100000212081_100015343762 [0,1,1,0,0,0|0,0,2]=4 945 B12R1.75 CCc1ccccc1NC(=O)C 22a_100000212081_100000070787 [0,1,1,0,0,0|0,0,2]=4 946 B12R1.75 CCc1ccccc1NC(=O)C 527a_100000212081_100103153847 [0,1,1,0,0,0|0,0,2]=4 947 B12R1.75 CNc1ccccc1NC(=O)C 34a_100011193560_200000210301 [0,1,1,0,0,0|1,0,1]=4 948 B12R1.75 COc1ccccc1NC(=O)C 11a_100000210025_100015343762 [0,1,1,0,0,0|1,0,1]=4 949 B12R1.75 COc1ccccc1NC(=O)C 1626a_100000210025_100015343762 [0,1,1,0,0,0|1,0,1]=4 950 B12R1.75 COc1ccccc1NC(=O)C 22a_100000210025_100000070787 [0,1,1,0,0,0|1,0,1]=4 951 B12R1.75 COc1ccccc1NC(=O)C 34a_100000185124_200000210301 [0,1,1,0,0,0|1,0,1]=4 952 B12R1.75 COc1ccccc1NC(=O)C 527a_100000210025_100103153847 [0,1,1,0,0,0|1,0,1]=4 953 B12R1.75 COc1ccccc1NC(=O)C 7a_100000185124_200000210301 [0,1,1,0,0,0|1,0,1]=4 954 B12R1.75 CSc1ccccc1NC(=O)C 11a_100000211160_100015343762 [0,1,1,0,0,0|1,0,1]=4 955 B12R1.75 CSc1ccccc1NC(=O)C 22a_100000211160_100000070787 [0,1,1,0,0,0|1,0,1]=4 956 B12R1.75 CSc1ccccc1NC(=O)C 62a_200000210301_100000153524 [0,1,1,0,0,0|1,0,1]=4 957 B12R1.75 CSc1ccccc1NC(=O)N 62a_200000210301_100000742221 [0,1,1,0,0,0|1,0,1]=4 958 B12R1.75 [13CH3]Sc1ccccc1NC(=O)N 62a_200025704644_100000742221 [0,1,1,0,0,0|1,0,1]=4 959 B12R1.169 C=C=Cc1ccccc1CC=C 271570a_100015277604_100009828059 [0,1,1,0,0,0|2,0,0]=4 960 B12R1.169 C=C=Cc1ccccc1NCC 271570a_100015277604_114873767003 [0,1,1,0,0,0|1,0,1]=4 961 B12R1.169 C=CCc1ccccc1C=CC 271570a_100016259895_100009828059 [0,1,1,0,0,0|2,0,0]=4 962 B12R1.169 C=CCc1ccccc1NCC 2230a_200138433279_100000210202 [0,1,1,0,0,0|1,0,1]=4 963 B12R1.169 C=CCc1ccccc1NCC 34a_200138433279_100000210202 [0,1,1,0,0,0|1,0,1]=4 964 B12R1.169 C=CCc1ccccc1NCF 34a_200138433279_100015361967 [0,1,1,0,0,0|1,0,1]=4 965 B12R1.169 CC=Cc1ccccc1NCC 271570a_100016259895_114873767003 [0,1,1,0,0,0|1,0,1]=4 966 B12R1.169 CCSc1ccccc1NC=O 62a_100000210202_200020615051 [0,1,1,0,0,0|0,0,2]=4 967 B12R1.169 CCSc1ccccc1NC=O 62a_200020615051_100000210202 [0,1,1,0,0,0|0,0,2]=4 968 B12R1.169 O=CNc1ccccc1SCF 62a_100015361967_200020615051 [0,1,1,0,0,0|1,0,1]=4 969 B12R1.169 O=CNc1ccccc1SCF 62a_200020615051_100015361967 [0,1,1,0,0,0|1,0,1]=4 970 B12R1.283 C=C(C)c1ccccc1NCC 271570a_100000694244_114873767003 [0,1,1,0,0,0|1,0,1]=4 971 B12R1.283 C=C(C)c1ccccc1NCC 34a_100000037685_100000210202 [0,1,1,0,0,0|1,0,1]=4 972 B12R1.283 C=C(C)c1ccccc1NCF 34a_100000037685_100015361967 [0,1,1,0,0,0|1,0,1]=4 973 B12R1.283 C=CCc1ccccc1C(=C)C 271570a_100000694244_100009828059 [0,1,1,0,0,0|2,0,0]=4 974 B12R1.233 CC(=Cc1ccc(=O)[nH]c1N)C 271570a_100102525489_100009884077 [0,1,1,0,0,0|1,0,1]=4 975 B12R1.1123 C=C=Cc1cc(c(=O)[nH]c1C)N 271570a_100015277604_100010126670 [0,1,1,0,0,0|0,0,2]=4 976 B12R1.1123 CC=Cc1cc(c(=O)[nH]c1C)N 271570a_100016259895_100010126670 [0,1,1,0,0,0|0,0,2]=4 977 B12R1.124 CC(=O)N(C)c1ccccc1Br 11a_100020606079_100015343762 [0,1,1,0,0,0|1,0,1]=4 978 B12R1.124 CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100015343762 [0,1,1,0,0,0|1,0,1]=4 979 B12R1.124 CC(=O)N(C)c1ccccc1C 11a_100000219699_100015343762 [0,1,1,0,0,0|0,0,2]=4 980 B12R1.124 CC(=O)N(C)c1ccccc1C 1626a_100000219699_100015343762 [0,1,1,0,0,0|0,0,2]=4 981 B12R1.124 CC(=O)N(C)c1ccccc1C 22a_100000219699_100000070787 [0,1,1,0,0,0|0,0,2]=4 982 B12R1.124 CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100015343762 [0,1,1,0,0,0|1,0,1]=4 983 B12R1.124 CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100015343762 [0,1,1,0,0,0|1,0,1]=4 984 B12R1.124 CC(=O)N(C)c1ccccc1F 11a_100000220357_100015343762 [0,1,1,0,0,0|1,0,1]=4 985 B12R1.124 CC(=O)N(C)c1ccccc1F 1626a_100000220357_100015343762 [0,1,1,0,0,0|1,0,1]=4 986 B12R1.124 CC(=O)N(C)c1ccccc1F 22a_100000220357_100000070787 [0,1,1,0,0,0|1,0,1]=4 987 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [0,1,1,0,0,0|1,0,1]=4 988 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [0,1,1,0,0,0|1,0,1]=4 989 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [0,1,1,0,0,0|1,0,1]=4 990 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [0,1,1,0,0,0|1,0,1]=4 991 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [0,1,1,0,0,0|1,0,1]=4 992 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [0,1,1,0,0,0|1,0,1]=4 993 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [0,1,1,0,0,0|1,0,1]=4 994 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [0,1,1,0,0,0|1,0,1]=4 995 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [0,1,1,0,0,0|1,0,1]=4 996 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [0,1,1,0,0,0|1,0,1]=4 997 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [0,1,1,0,0,0|1,0,1]=4 998 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [0,1,1,0,0,0|1,0,1]=4 999 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [0,1,1,0,0,0|1,0,1]=4 1000 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [0,1,1,0,0,0|1,0,1]=4 1001 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [0,1,1,0,0,0|0,0,2]=4 1002 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [0,1,1,0,0,0|0,0,2]=4 1003 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [0,1,1,0,0,0|0,0,2]=4 1004 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [0,1,1,0,0,0|0,0,2]=4 1005 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [0,1,1,0,0,0|0,0,2]=4 1006 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [0,1,1,0,0,0|0,0,2]=4 1007 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [0,1,1,0,0,0|0,0,2]=4 1008 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [0,1,1,0,0,0|0,0,2]=4 1009 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [0,1,1,0,0,0|0,0,2]=4 1010 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [0,1,1,0,0,0|0,0,2]=4 1011 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [0,1,1,0,0,0|0,0,2]=4 1012 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [0,1,1,0,0,0|0,0,2]=4 1013 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [0,1,1,0,0,0|0,0,2]=4 1014 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [0,1,1,0,0,0|0,0,2]=4 1015 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [0,1,1,0,0,0|0,0,2]=4 1016 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [0,1,1,0,0,0|0,0,2]=4 1017 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [0,1,1,0,0,0|0,0,2]=4 1018 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [0,1,1,0,0,0|0,0,2]=4 1019 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [0,1,1,0,0,0|0,0,2]=4 1020 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [0,1,1,0,0,0|0,0,2]=4 1021 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [0,1,1,0,0,0|0,0,2]=4 1022 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [0,1,1,0,0,0|1,0,1]=4 1023 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [0,1,1,0,0,0|1,0,1]=4 1024 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [0,1,1,0,0,0|1,0,1]=4 1025 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [0,1,1,0,0,0|1,0,1]=4 1026 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [0,1,1,0,0,0|1,0,1]=4 1027 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [0,1,1,0,0,0|1,0,1]=4 1028 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [0,1,1,0,0,0|1,0,1]=4 1029 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [0,1,1,0,0,0|1,0,1]=4 1030 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [0,1,1,0,0,0|1,0,1]=4 1031 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [0,1,1,0,0,0|1,0,1]=4 1032 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [0,1,1,0,0,0|1,0,1]=4 1033 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [0,1,1,0,0,0|1,0,1]=4 1034 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [0,1,1,0,0,0|1,0,1]=4 1035 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [0,1,1,0,0,0|1,0,1]=4 1036 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [0,1,1,0,0,0|1,0,1]=4 1037 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [0,1,1,0,0,0|1,0,1]=4 1038 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [0,1,1,0,0,0|1,0,1]=4 1039 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [0,1,1,0,0,0|1,0,1]=4 1040 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [0,1,1,0,0,0|1,0,1]=4 1041 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [0,1,1,0,0,0|1,0,1]=4 1042 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [0,1,1,0,0,0|1,0,1]=4 1043 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [0,1,1,0,0,0|1,0,1]=4 1044 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [0,1,1,0,0,0|1,0,1]=4 1045 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [0,1,1,0,0,0|1,0,1]=4 1046 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [0,1,1,0,0,0|1,0,1]=4 1047 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [0,1,1,0,0,0|1,0,1]=4 1048 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [0,1,1,0,0,0|1,0,1]=4 1049 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [0,1,1,0,0,0|1,0,1]=4 1050 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [0,1,1,0,0,0|1,0,1]=4 1051 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [0,1,1,0,0,0|1,0,1]=4 1052 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [0,1,1,0,0,0|1,0,1]=4 1053 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [0,1,1,0,0,0|1,0,1]=4 1054 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [0,1,1,0,0,0|1,0,1]=4 1055 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [0,1,1,0,0,0|1,0,1]=4 1056 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [0,1,1,0,0,0|1,0,1]=4 1057 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [0,1,1,0,0,0|1,0,1]=4 1058 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [0,1,1,0,0,0|1,0,1]=4 1059 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [0,1,1,0,0,0|1,0,1]=4 1060 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [0,1,1,0,0,0|1,0,1]=4 1061 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,1,1,0,0,0|1,0,1]=4 1062 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,1,1,0,0,0|1,0,1]=4 1063 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,1,1,0,0,0|1,0,1]=4 1064 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,1,1,0,0,0|1,0,1]=4 1065 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,1,1,0,0,0|1,0,1]=4 1066 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,1,1,0,0,0|1,0,1]=4 1067 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,1,1,0,0,0|1,0,1]=4 1068 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,1,1,0,0,0|1,0,1]=4 1069 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,1,1,0,0,0|1,0,1]=4 1070 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,1,1,0,0,0|1,0,1]=4 1071 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,1,1,0,0,0|1,0,1]=4 1072 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,1,1,0,0,0|1,0,1]=4 1073 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,1,1,0,0,0|1,0,1]=4 1074 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,1,1,0,0,0|1,0,1]=4 1075 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,1,1,0,0,0|1,0,1]=4 1076 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100015343762 [0,1,1,0,0,0|1,0,1]=4 1077 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100015343762 [0,1,1,0,0,0|1,0,1]=4 1078 B12R1.224 CC(=O)Nc1cccc(c1Br)F 11a_100011934729_100015343762 [0,1,1,0,0,0|1,0,1]=4 1079 B12R1.224 CC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100015343762 [0,1,1,0,0,0|1,0,1]=4 1080 B12R1.224 CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000070787 [0,1,1,0,0,0|1,0,1]=4 1081 B12R1.224 CC(=O)Nc1cccc(c1C)Br 11a_100000750434_100015343762 [0,1,1,0,0,0|0,0,2]=4 1082 B12R1.224 CC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100015343762 [0,1,1,0,0,0|0,0,2]=4 1083 B12R1.224 CC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000070787 [0,1,1,0,0,0|0,0,2]=4 1084 B12R1.224 CC(=O)Nc1cccc(c1C)Br 527a_100000750434_100103153847 [0,1,1,0,0,0|0,0,2]=4 1085 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,1,1,0,0,0|0,0,2]=4 1086 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,1,1,0,0,0|0,0,2]=4 1087 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,1,1,0,0,0|0,0,2]=4 1088 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,1,1,0,0,0|0,0,2]=4 1089 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100015343762 [0,1,1,0,0,0|0,0,2]=4 1090 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100015343762 [0,1,1,0,0,0|0,0,2]=4 1091 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000070787 [0,1,1,0,0,0|0,0,2]=4 1092 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100103153847 [0,1,1,0,0,0|0,0,2]=4 1093 B12R1.224 CC(=O)Nc1cccc(c1C)F 11a_100000745574_100015343762 [0,1,1,0,0,0|0,0,2]=4 1094 B12R1.224 CC(=O)Nc1cccc(c1C)F 1626a_100000745574_100015343762 [0,1,1,0,0,0|0,0,2]=4 1095 B12R1.224 CC(=O)Nc1cccc(c1C)F 22a_100000745574_100000070787 [0,1,1,0,0,0|0,0,2]=4 1096 B12R1.224 CC(=O)Nc1cccc(c1C)F 527a_100000745574_100103153847 [0,1,1,0,0,0|0,0,2]=4 1097 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [0,1,1,0,0,0|0,0,2]=4 1098 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [0,1,1,0,0,0|0,0,2]=4 1099 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [0,1,1,0,0,0|0,0,2]=4 1100 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [0,1,1,0,0,0|0,0,2]=4 1101 B12R1.224 CC(=O)Nc1cccc(c1C)O 11a_100011216573_100015343762 [0,1,1,0,0,0|0,0,2]=4 1102 B12R1.224 CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000070787 [0,1,1,0,0,0|0,0,2]=4 1103 B12R1.224 CC(=O)Nc1cccc(c1C)O 527a_100011216573_100103153847 [0,1,1,0,0,0|0,0,2]=4 1104 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100015343762 [0,1,1,0,0,0|1,0,1]=4 1105 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100015343762 [0,1,1,0,0,0|1,0,1]=4 1106 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100103153847 [0,1,1,0,0,0|1,0,1]=4 1107 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,1,1,0,0,0|1,0,1]=4 1108 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,1,1,0,0,0|1,0,1]=4 1109 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,1,1,0,0,0|1,0,1]=4 1110 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100015343762 [0,1,1,0,0,0|1,0,1]=4 1111 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100015343762 [0,1,1,0,0,0|1,0,1]=4 1112 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100015343762 [0,1,1,0,0,0|1,0,1]=4 1113 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100015343762 [0,1,1,0,0,0|1,0,1]=4 1114 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000070787 [0,1,1,0,0,0|1,0,1]=4 1115 B12R1.224 CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000070787 [0,1,1,0,0,0|1,0,1]=4 1116 B12R1.224 CC(=O)Nc1cccc(c1F)Br 11a_100011935091_100015343762 [0,1,1,0,0,0|1,0,1]=4 1117 B12R1.224 CC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100015343762 [0,1,1,0,0,0|1,0,1]=4 1118 B12R1.224 CC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000070787 [0,1,1,0,0,0|1,0,1]=4 1119 B12R1.224 CC(=O)Nc1cccc(c1F)Br 527a_100011935091_100103153847 [0,1,1,0,0,0|1,0,1]=4 1120 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,1,1,0,0,0|1,0,1]=4 1121 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,1,1,0,0,0|1,0,1]=4 1122 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,1,1,0,0,0|1,0,1]=4 1123 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100015343762 [0,1,1,0,0,0|1,0,1]=4 1124 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100015343762 [0,1,1,0,0,0|1,0,1]=4 1125 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000070787 [0,1,1,0,0,0|1,0,1]=4 1126 B12R1.224 CC(=O)Nc1cccc(c1F)F 11a_100000743855_100015343762 [0,1,1,0,0,0|1,0,1]=4 1127 B12R1.224 CC(=O)Nc1cccc(c1F)F 1626a_100000743855_100015343762 [0,1,1,0,0,0|1,0,1]=4 1128 B12R1.224 CC(=O)Nc1cccc(c1F)F 22a_100000743855_100000070787 [0,1,1,0,0,0|1,0,1]=4 1129 B12R1.224 CC(=O)Nc1cccc(c1I)Br 11a_100020590159_100015343762 [0,1,1,0,0,0|1,0,1]=4 1130 B12R1.224 CC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100015343762 [0,1,1,0,0,0|1,0,1]=4 1131 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,1,1,0,0,0|1,0,1]=4 1132 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,1,1,0,0,0|1,0,1]=4 1133 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100015343762 [0,1,1,0,0,0|1,0,1]=4 1134 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100015343762 [0,1,1,0,0,0|1,0,1]=4 1135 B12R1.224 CC(=O)Nc1cccc(c1I)F 11a_100000690935_100015343762 [0,1,1,0,0,0|1,0,1]=4 1136 B12R1.224 CC(=O)Nc1cccc(c1I)F 1626a_100000690935_100015343762 [0,1,1,0,0,0|1,0,1]=4 1137 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,1,1,0,0,0|1,0,1]=4 1138 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,1,1,0,0,0|1,0,1]=4 1139 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,1,1,0,0,0|1,0,1]=4 1140 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,1,1,0,0,0|1,0,1]=4 1141 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,1,1,0,0,0|1,0,1]=4 1142 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,1,1,0,0,0|1,0,1]=4 1143 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,1,1,0,0,0|1,0,1]=4 1144 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,1,1,0,0,0|1,0,1]=4 1145 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,1,1,0,0,0|1,0,1]=4 1146 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,1,1,0,0,0|1,0,1]=4 1147 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,1,1,0,0,0|1,0,1]=4 1148 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,1,1,0,0,0|1,0,1]=4 1149 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,1,1,0,0,0|1,0,1]=4 1150 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,1,1,0,0,0|1,0,1]=4 1151 B12R1.1009 CC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100015343762 [0,1,1,0,0,0|1,0,1]=4 1152 B12R1.1009 CC(=O)Nc1c(cccc1Br)C 11a_100011834072_100015343762 [0,1,1,0,0,0|0,0,2]=4 1153 B12R1.1009 CC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100015343762 [0,1,1,0,0,0|0,0,2]=4 1154 B12R1.1009 CC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100015343762 [0,1,1,0,0,0|1,0,1]=4 1155 B12R1.1009 CC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100015343762 [0,1,1,0,0,0|1,0,1]=4 1156 B12R1.1009 CC(=O)Nc1c(cccc1Br)F 11a_100000684712_100015343762 [0,1,1,0,0,0|1,0,1]=4 1157 B12R1.1009 CC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100015343762 [0,1,1,0,0,0|1,0,1]=4 1158 B12R1.1009 CC(=O)Nc1c(cccc1Br)O 527a_100011934926_100103153847 [0,1,1,0,0,0|1,0,1]=4 1159 B12R1.1009 CC(=O)Nc1c(cccc1C)C 11a_100000185769_100015343762 [0,1,1,0,0,0|0,0,2]=4 1160 B12R1.1009 CC(=O)Nc1c(cccc1C)C 1626a_100000185769_100015343762 [0,1,1,0,0,0|0,0,2]=4 1161 B12R1.1009 CC(=O)Nc1c(cccc1C)C 22a_100000185769_100000070787 [0,1,1,0,0,0|0,0,2]=4 1162 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100015343762 [0,1,1,0,0,0|0,0,2]=4 1163 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100015343762 [0,1,1,0,0,0|0,0,2]=4 1164 B12R1.1009 CC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100015343762 [0,1,1,0,0,0|1,0,1]=4 1165 B12R1.1009 CC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100015343762 [0,1,1,0,0,0|1,0,1]=4 1166 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100015343762 [0,1,1,0,0,0|1,0,1]=4 1167 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100015343762 [0,1,1,0,0,0|1,0,1]=4 1168 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000070787 [0,1,1,0,0,0|1,0,1]=4 1169 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100103153847 [0,1,1,0,0,0|1,0,1]=4 1170 B12R1.1009 CC(=O)Nc1c(cccc1F)C 11a_100000766463_100015343762 [0,1,1,0,0,0|0,0,2]=4 1171 B12R1.1009 CC(=O)Nc1c(cccc1F)C 1626a_100000766463_100015343762 [0,1,1,0,0,0|0,0,2]=4 1172 B12R1.1009 CC(=O)Nc1c(cccc1F)C 22a_100000766463_100000070787 [0,1,1,0,0,0|0,0,2]=4 1173 B12R1.1009 CC(=O)Nc1c(cccc1F)F 11a_100000210704_100015343762 [0,1,1,0,0,0|1,0,1]=4 1174 B12R1.1009 CC(=O)Nc1c(cccc1F)F 1626a_100000210704_100015343762 [0,1,1,0,0,0|1,0,1]=4 1175 B12R1.1009 CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000070787 [0,1,1,0,0,0|1,0,1]=4 1176 B12R1.1009 CC(=O)Nc1c(cccc1F)O 527a_100020591140_100103153847 [0,1,1,0,0,0|1,0,1]=4 1177 B12R1.1009 CC(=O)Nc1c(cccc1I)Br 11a_100010146558_100015343762 [0,1,1,0,0,0|1,0,1]=4 1178 B12R1.1009 CC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100015343762 [0,1,1,0,0,0|1,0,1]=4 1179 B12R1.1009 CC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100015343762 [0,1,1,0,0,0|1,0,1]=4 1180 B12R1.1009 CC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100015343762 [0,1,1,0,0,0|1,0,1]=4 1181 B12R1.1009 CC(=O)Nc1c(cccc1I)F 11a_100000042321_100015343762 [0,1,1,0,0,0|1,0,1]=4 1182 B12R1.1009 CC(=O)Nc1c(cccc1I)F 1626a_100000042321_100015343762 [0,1,1,0,0,0|1,0,1]=4 1183 B12R1.1009 CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000070787 [0,1,1,0,0,0|1,0,1]=4 1184 B12R1.1009 CC(=O)Nc1c(cccc1I)O 527a_200000049512_100103153847 [0,1,1,0,0,0|1,0,1]=4 1185 B12R1.1009 CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000070787 [0,1,1,0,0,0|0,0,2]=4 1186 B12R1.1009 CC(=O)Nc1c(cccc1O)C 527a_100000743429_100103153847 [0,1,1,0,0,0|0,0,2]=4 1187 B12R1.1009 CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000070787 [0,1,1,0,0,0|1,0,1]=4 1188 B12R1.1009 CC(=O)Nc1c(cccc1O)O 527a_100011995820_100103153847 [0,1,1,0,0,0|1,0,1]=4 1189 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [0,1,1,0,0,0|1,0,0]=3 1190 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [0,1,1,0,0,0|2,0,0]=4 1191 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [0,1,1,0,0,0|2,0,0]=4 1192 B12R1.27 CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210202 [0,1,1,0,0,0|2,0,0]=4 1193 B12R1.27 CNC(=O)C#Cc1ccccc1 240690a_100102657272_100000736102 [0,1,1,0,0,0|0,0,2]=4 1194 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [0,1,1,0,0,0|0,0,0]=2 1195 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [0,1,1,0,0,0|0,0,0]=2 1196 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [0,1,1,0,0,0|1,0,0]=3 1197 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [0,1,1,0,0,0|1,0,0]=3 1198 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [0,1,1,0,0,0|1,0,0]=3 1199 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [0,1,1,0,0,0|1,0,0]=3 1200 B12R1.27 CNC(=O)C=Cc1ccncc1 240690a_100102657272_100000682801 [0,1,1,0,0,0|1,0,0]=3 1201 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [0,1,1,0,0,0|0,0,2]=4 1202 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [0,1,1,0,0,0|0,0,2]=4 1203 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [0,1,1,0,0,0|0,0,2]=4 1204 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [0,1,1,0,0,0|0,0,2]=4 1205 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [0,1,1,0,0,0|1,0,1]=4 1206 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [0,1,1,0,0,0|1,0,1]=4 1207 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [0,1,1,0,0,0|1,0,1]=4 1208 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [0,1,1,0,0,0|1,0,1]=4 1209 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [0,1,1,0,0,0|1,0,1]=4 1210 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [0,1,1,0,0,0|1,0,1]=4 1211 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [0,1,1,0,0,0|1,0,1]=4 1212 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [0,1,1,0,0,0|1,0,1]=4 1213 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [0,1,1,0,0,0|1,0,1]=4 1214 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [0,1,1,0,0,0|1,0,1]=4 1215 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [0,1,1,0,0,0|1,0,1]=4 1216 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [0,1,1,0,0,0|1,0,1]=4 1217 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [0,1,1,0,0,0|1,0,1]=4 1218 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100015324214_106832991635 [0,1,1,0,0,0|1,0,1]=4 1219 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100102657272_100015324214 [0,1,1,0,0,0|1,0,1]=4 1220 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100015324214_100102657272 [0,1,1,0,0,0|1,0,1]=4 1221 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100102657272_100015324214 [0,1,1,0,0,0|1,0,1]=4 1222 B12R1.27 CNC(=O)NCc1ccccc1 512a_100015324214_100102657272 [0,1,1,0,0,0|1,0,1]=4 1223 B12R1.27 CNC(=O)NCc1ccccc1 512a_106832991638_100015324214 [0,1,1,0,0,0|1,0,1]=4 1224 B12R1.27 CNC(=O)NNc1ccccc1 273464a_100102657272_100015195140 [0,1,1,0,0,0|2,0,0]=4 1225 B12R1.27 CNC(=O)NNc1ccccc1 512a_106832991638_100015195140 [0,1,1,0,0,0|2,0,0]=4 1226 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [0,1,1,0,0,0|1,0,0]=3 1227 B12R1.27 O=C(C=Cc1ccccn1)CF 1458a_100000740811_100015361967 [0,1,1,0,0,0|2,0,0]=4 1228 B12R1.27 O=C(C=Cc1cccnc1)CF 1458a_100000735890_100015361967 [0,1,1,0,0,0|2,0,0]=4 1229 B12R1.27 O=C(C=Cc1ccncc1)CF 1458a_100000682801_100015361967 [0,1,1,0,0,0|2,0,0]=4 1230 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [0,1,1,0,0,0|1,0,0]=3 1231 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [0,1,1,0,0,0|1,0,0]=3 1232 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [0,1,1,0,0,0|1,0,1]=4 1233 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000210012_100000747473 [0,1,1,0,0,0|1,0,1]=4 1234 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000212578_200000210301 [0,1,1,0,0,0|1,0,1]=4 1235 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000210012_100000187820 [0,1,1,0,0,0|1,0,1]=4 1236 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000212578_200000210301 [0,1,1,0,0,0|1,0,1]=4 1237 B12R1.107 CN(CC(=O)N)c1ccccc1 34a_100000210012_100000187820 [0,1,1,0,0,0|1,0,1]=4 1238 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [0,1,1,0,0,0|0,0,1]=3 1239 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [0,1,1,0,0,0|1,0,1]=4 1240 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 2230a_100000212578_200025704644 [0,1,1,0,0,0|1,0,1]=4 1241 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 269982a_100000212578_200025704644 [0,1,1,0,0,0|1,0,1]=4 1242 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [1,1,0,0,0,0|1,0,0]=3 1243 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [1,1,0,0,0,0|0,0,1]=3 1244 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [1,1,0,0,0,0|2,0,0]=4 1245 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [1,1,0,0,0,0|2,0,0]=4 1246 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [1,1,0,0,0,0|1,0,1]=4 1247 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [1,1,0,0,0,0|0,0,1]=3 1248 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [1,1,0,0,0,0|1,0,1]=4 1249 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [1,1,0,0,0,0|1,0,1]=4 1250 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [1,1,0,0,0,0|0,0,1]=3 1251 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [1,1,0,0,0,0|1,0,1]=4 1252 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [1,1,0,0,0,0|1,0,1]=4 1253 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [1,1,0,0,0,0|2,0,0]=4 1254 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [1,1,0,0,0,0|1,0,1]=4 1255 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [1,1,0,0,0,0|1,0,1]=4 1256 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [1,1,0,0,0,0|2,0,0]=4 1257 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [1,1,0,0,0,0|1,0,1]=4 1258 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [1,1,0,0,0,0|1,0,1]=4 1259 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [1,1,0,0,0,0|1,0,1]=4 1260 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [0,1,0,0,1,0|2,0,0]=4 1261 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [0,1,0,0,1,0|2,0,0]=4 1262 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,0,1,0|1,0,1]=4 1263 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,0,1,0|1,0,1]=4 1264 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,0,1,0|1,1,0]=4 1265 B12R2.1 CSc1csc2c1cccc2 62a_200000210301_100009813928 [0,1,0,0,1,0|1,1,0]=4 1266 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,0,1,0|1,0,1]=4 1267 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,0,1,0|1,0,1]=4 1268 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,0,1,0|1,1,0]=4 1269 B12R2.1 [13CH3]Sc1csc2c1cccc2 62a_200025704644_100009813928 [0,1,0,0,1,0|1,1,0]=4 1270 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,1,0|2,0,0]=4 1271 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,1,0|1,0,1]=4 1272 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,1,0|1,0,1]=4 1273 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,0,1,0|2,0,0]=4 1274 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,0,1,0|2,0,0]=4 1275 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,0,1,0|2,0,0]=4 1276 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [0,1,0,0,1,0|2,0,0]=4 1277 B12R2.132 Nc1ccc2scc(c2c1)O 271570a_203496583355_100011178648 [0,1,0,0,1,0|1,0,1]=4 1278 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,0,1,0|0,0,2]=4 1279 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,0,1,0|1,0,1]=4 1280 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,1,0,0,1,0|1,0,1]=4 1281 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,0,1,0|1,0,1]=4 1282 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,1,0,0,1,0|2,0,0]=4 1283 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,0,1,0|2,0,0]=4 1284 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,0,1,0|2,0,0]=4 1285 B12R2.196 Cn1ccc2c1cccc2O 271570a_203496583355_200011934935 [0,1,0,0,1,0|2,0,0]=4 1286 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,0,1,0|0,0,2]=4 1287 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,0,1,0|1,0,1]=4 1288 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,0,1,0|1,0,1]=4 1289 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,0,1,0|1,0,1]=4 1290 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,0,1,0|2,0,0]=4 1291 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [0,1,0,0,1,0|2,0,0]=4 1292 B12R2.203 Cn1ccc2c1c(ccc2)O 271570a_203496583355_100009817156 [0,1,0,0,1,0|2,0,0]=4 1293 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [0,1,0,0,1,0|0,0,2]=4 1294 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [0,1,0,0,1,0|1,0,1]=4 1295 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [0,1,0,0,1,0|1,0,1]=4 1296 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [0,1,0,0,1,0|1,0,1]=4 1297 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [0,1,0,0,1,0|2,0,0]=4 1298 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,0,1,0|2,0,0]=4 1299 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,0,1,0|2,0,0]=4 1300 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [0,1,0,0,1,0|2,0,0]=4 1301 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,0,1,0|0,0,0]=2 1302 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,0,1,0|0,0,2]=4 1303 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,0,1,0|1,0,1]=4 1304 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,0,1,0|1,0,1]=4 1305 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,0,1,0|1,0,1]=4 1306 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,0,1,0|2,0,0]=4 1307 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,1,0,0,1,0|1,0,0]=3 1308 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,1,0,0,1,0|2,0,0]=4 1309 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,1,0,0,1,0|2,0,0]=4 1310 B12R2.32 C=Cc1cc2cccnc2[nH]1 271570a_100011290941_100010079843 [0,1,0,0,1,0|2,0,0]=4 1311 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,1,0,0,1,0|2,0,0]=4 1312 B12R2.32 CNc1nc2ccccc2[nH]1 27a_100102657272_100009814255 [0,1,0,0,1,0|2,0,0]=4 1313 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,1,0,0,1,0|0,1,0]=3 1314 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,0,1,0|1,1,0]=4 1315 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,1,0,0,1,0|1,1,0]=4 1316 B12R2.32 CSc1cc2cccnc2[nH]1 62a_200000210301_100010079843 [0,1,0,0,1,0|1,1,0]=4 1317 B12R2.32 CSc1nc2ccccc2[nH]1 62a_200000210301_100009814255 [0,1,0,0,1,0|1,1,0]=4 1318 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,1,0,0,1,0|0,1,0]=3 1319 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,0,1,0|1,1,0]=4 1320 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,1,0,0,1,0|1,1,0]=4 1321 B12R2.32 [13CH3]Sc1cc2cccnc2[nH]1 62a_200025704644_100010079843 [0,1,0,0,1,0|1,1,0]=4 1322 B12R2.32 [13CH3]Sc1nc2ccccc2[nH]1 62a_200025704644_100009814255 [0,1,0,0,1,0|1,1,0]=4 1323 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,1,0|2,0,0]=4 1324 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,1,0|1,0,0]=3 1325 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,0,1,0|2,0,0]=4 1326 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,0,1,0|2,0,0]=4 1327 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,0,1,0|2,0,0]=4 1328 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,0,1,0|2,0,0]=4 1329 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,0,1,0|0,0,1]=3 1330 B12R2.202 O=C1Cc2c(ccnc2N1)O 271570a_203496583355_100000104061 [0,1,0,0,1,0|1,0,1]=4 1331 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,0,1,0|1,0,1]=4 1332 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,0,1,0|0,0,1]=3 1333 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,1,0,0,1,0|1,0,0]=3 1334 B12R2.202 O=c1[nH]c2nccc(c2[nH]1)O 271570a_203496583355_100009840862 [0,1,0,0,1,0|2,0,0]=4 1335 B12R2.202 Oc1cc2c(ccnc2[nH]1)Cl 271570a_203496583355_100010234028 [0,1,0,0,1,0|1,0,1]=4 1336 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,0,1,0|0,0,1]=3 1337 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,0,1,0|1,0,1]=4 1338 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,0,1,0|1,0,0]=3 1339 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,0,1,0|2,0,0]=4 1340 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,1,0,0,1,0|2,0,0]=4 1341 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,0,1,0|1,0,0]=3 1342 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,1,0,0,1,0|2,0,0]=4 1343 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,1,0,0,1,0|2,0,0]=4 1344 B12R2.606 Nc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000764686 [0,1,0,0,1,0|2,0,0]=4 1345 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,0,1,0|0,0,1]=3 1346 B12R2.606 O=C1Cc2cc(cnc2N1)O 271570a_203496583355_100010177629 [0,1,0,0,1,0|1,0,1]=4 1347 B12R2.606 O=C1Cc2cc(ncc2N1)O 271570a_203496583355_100000104063 [0,1,0,0,1,0|1,0,1]=4 1348 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,0,1,0|1,0,1]=4 1349 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,0,1,0|0,0,1]=3 1350 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [0,1,0,0,1,0|1,0,1]=4 1351 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [0,1,0,0,1,0|1,0,1]=4 1352 B12R2.606 O=C1Cc2nc(ccc2N1)O 271570a_203496583355_100000087150 [0,1,0,0,1,0|1,0,1]=4 1353 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [0,1,0,0,1,0|1,0,1]=4 1354 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,0,1,0|1,0,0]=3 1355 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,1,0,0,1,0|1,0,0]=3 1356 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,1,0,0,1,0|1,0,0]=3 1357 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,1,0,0,1,0|1,0,0]=3 1358 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,1,0,0,1,0|1,0,0]=3 1359 B12R2.606 O=c1[nH]c2ccc(nc2[nH]1)O 271570a_203496583355_100000084209 [0,1,0,0,1,0|2,0,0]=4 1360 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [0,1,0,0,1,0|2,0,0]=4 1361 B12R2.606 Oc1cc2cc(ccc2[nH]1)Br 271570a_203496583355_100011012855 [0,1,0,0,1,0|0,0,1]=3 1362 B12R2.606 Oc1cc2cc(ccc2s1)Br 271570a_203496583355_200010198765 [0,1,0,0,1,0|1,0,1]=4 1363 B14R2.7974 O=C1CCCc2cc(ccc2N1)O 271570a_203496583355_100000694693 [0,1,0,0,0,1|0,0,2]=4 1364 B14R2.7974 O=C1CCNc2cc(ccc2N1)O 271570a_203496583355_200012359944 [0,1,0,0,0,1|0,0,2]=4 1365 B14R2.28454 O=C1CCCc2c(cccc2N1)O 271570a_203496583355_200000700058 [0,1,0,0,0,1|0,0,2]=4 1366 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [0,2,0,0,0,0|2,0,0]=4 1367 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [0,2,0,0,0,0|2,0,0]=4 1368 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [0,2,0,0,0,0|2,0,0]=4 1369 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [0,2,0,0,0,0|2,0,0]=4 1370 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [0,2,0,0,0,0|2,0,0]=4 1371 B14R2.92 CNc1ccc2ccccc2c1Br 34a_100000705303_200000210301 [0,2,0,0,0,0|2,0,0]=4 1372 B14R2.92 CNc1ccc2ccccc2c1Cl 34a_100000075557_200000210301 [0,2,0,0,0,0|2,0,0]=4 1373 B14R2.92 CNc1ccc2ccccc2c1O 34a_100000007060_200000210301 [0,2,0,0,0,0|2,0,0]=4 1374 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [0,2,0,0,0,0|1,0,1]=4 1375 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [0,2,0,0,0,0|1,0,1]=4 1376 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,2,0,0,0,0|1,0,1]=4 1377 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,2,0,0,0,0|1,0,1]=4 1378 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [0,2,0,0,0,0|1,0,1]=4 1379 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [0,2,0,0,0,0|1,0,1]=4 1380 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [0,2,0,0,0,0|1,0,1]=4 1381 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [0,2,0,0,0,0|1,0,1]=4 1382 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [0,2,0,0,0,0|1,0,1]=4 1383 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [0,2,0,0,0,0|1,0,1]=4 1384 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [0,2,0,0,0,0|1,0,1]=4 1385 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200000210301_200010089984 [0,2,0,0,0,0|1,1,0]=4 1386 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200010089984_200000210301 [0,2,0,0,0,0|1,1,0]=4 1387 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [0,2,0,0,0,0|1,1,0]=4 1388 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [0,2,0,0,0,0|1,1,0]=4 1389 B14R2.92 CSc1ccc2ccccc2c1F 62a_100009832041_200000210301 [0,2,0,0,0,0|1,1,0]=4 1390 B14R2.92 CSc1ccc2ccccc2c1F 62a_200000210301_100009832041 [0,2,0,0,0,0|1,1,0]=4 1391 B14R2.92 CSc1ccc2ccccc2c1N 62a_100009817101_200000210301 [0,2,0,0,0,0|1,1,0]=4 1392 B14R2.92 CSc1ccc2ccccc2c1O 62a_200000210301_100009996032 [0,2,0,0,0,0|1,1,0]=4 1393 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,2,0,0,0,0|1,0,1]=4 1394 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,2,0,0,0,0|1,0,1]=4 1395 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [0,2,0,0,0,0|1,1,0]=4 1396 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [0,2,0,0,0,0|1,1,0]=4 1397 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [0,2,0,0,0,0|1,0,0]=3 1398 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Br 34a_100000705303_200025704644 [0,2,0,0,0,0|2,0,0]=4 1399 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Cl 34a_100000075557_200025704644 [0,2,0,0,0,0|2,0,0]=4 1400 B14R2.92 [13CH3]Nc1ccc2ccccc2c1O 34a_100000007060_200025704644 [0,2,0,0,0,0|2,0,0]=4 1401 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [0,2,0,0,0,0|1,0,1]=4 1402 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [0,2,0,0,0,0|1,0,1]=4 1403 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [0,2,0,0,0,0|1,0,1]=4 1404 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [0,2,0,0,0,0|1,0,1]=4 1405 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [0,2,0,0,0,0|1,0,1]=4 1406 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [0,2,0,0,0,0|1,0,1]=4 1407 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [0,2,0,0,0,0|1,0,1]=4 1408 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [0,2,0,0,0,0|1,0,1]=4 1409 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200010089984_200025704644 [0,2,0,0,0,0|1,1,0]=4 1410 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200025704644_200010089984 [0,2,0,0,0,0|1,1,0]=4 1411 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_100009832041_200025704644 [0,2,0,0,0,0|1,1,0]=4 1412 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_200025704644_100009832041 [0,2,0,0,0,0|1,1,0]=4 1413 B14R2.92 [13CH3]Sc1ccc2ccccc2c1N 62a_100009817101_200025704644 [0,2,0,0,0,0|1,1,0]=4 1414 B14R2.92 [13CH3]Sc1ccc2ccccc2c1O 62a_200025704644_100009996032 [0,2,0,0,0,0|1,1,0]=4 1415 B14R2.203 C=Cc1c(ccc2c1cccc2)Br 271570a_100011290941_100010090040 [0,2,0,0,0,0|2,0,0]=4 1416 B14R2.203 C=Cc1c(ccc2c1cccc2)C 271570a_100011290941_100000759710 [0,2,0,0,0,0|2,0,0]=4 1417 B14R2.203 C=Cc1c(ccc2c1cccc2)N 271570a_100011290941_100000705303 [0,2,0,0,0,0|2,0,0]=4 1418 B14R2.203 C=Cc1c(ccc2c1cccc2)O 271570a_100011290941_100000183829 [0,2,0,0,0,0|1,0,1]=4 1419 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [0,2,0,0,0,0|2,0,0]=4 1420 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [0,2,0,0,0,0|2,0,0]=4 1421 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [0,2,0,0,0,0|2,0,0]=4 1422 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [0,2,0,0,0,0|1,0,1]=4 1423 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 1424 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [0,2,0,0,0,0|2,0,0]=4 1425 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [0,2,0,0,0,0|2,0,0]=4 1426 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [0,2,0,0,0,0|2,0,0]=4 1427 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [0,2,0,0,0,0|2,0,0]=4 1428 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [0,2,0,0,0,0|1,0,1]=4 1429 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [0,2,0,0,0,0|2,0,0]=4 1430 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [0,2,0,0,0,0|2,0,0]=4 1431 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [0,2,0,0,0,0|2,0,0]=4 1432 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [0,2,0,0,0,0|2,0,0]=4 1433 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [0,2,0,0,0,0|2,0,0]=4 1434 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [0,2,0,0,0,0|2,0,0]=4 1435 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [0,2,0,0,0,0|1,0,1]=4 1436 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [0,2,0,0,0,0|2,0,0]=4 1437 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [0,2,0,0,0,0|2,0,0]=4 1438 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [0,2,0,0,0,0|2,0,0]=4 1439 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [0,2,0,0,0,0|2,0,0]=4 1440 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [0,2,0,0,0,0|2,0,0]=4 1441 B14R2.203 O=Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010090029 [0,2,0,0,0,0|1,0,1]=4 1442 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [0,2,0,0,0,0|2,0,0]=4 1443 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [0,2,0,0,0,0|2,0,0]=4 1444 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [0,2,0,0,0,0|1,0,1]=4 1445 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 1446 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [0,2,0,0,0,0|2,0,0]=4 1447 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [0,2,0,0,0,0|2,0,0]=4 1448 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [0,2,0,0,0,0|2,0,0]=4 1449 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [0,2,0,0,0,0|2,0,0]=4 1450 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [0,2,0,0,0,0|2,0,0]=4 1451 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [0,2,0,0,0,0|2,0,0]=4 1452 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [0,2,0,0,0,0|1,0,1]=4 1453 B14R2.4513 CN1C(=O)COc2c1cc(cc2)O 271570a_203496583355_100010196913 [0,2,0,0,0,0|1,0,1]=4 1454 B14R2.4513 Cc1c(ccc2c1NC(=O)CO2)O 271570a_203496583355_100010272156 [0,2,0,0,0,0|1,0,1]=4 1455 B14R2.4513 Cn1c(=O)ccc2c1cc(cc2)O 271570a_203496583355_200010167779 [0,2,0,0,0,0|0,0,0]=2 1456 B14R2.4513 Cn1c(=O)cnc2c1cc(cc2)O 271570a_203496583355_100010221214 [0,2,0,0,0,0|1,0,0]=3 1457 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [0,2,0,0,0,0|0,0,0]=2 1458 B14R2.8188 Cc1c(c(nc2c1cccc2)O)O 271570a_203496583355_100009820873 [0,2,0,0,0,0|0,0,2]=4 1459 B14R2.29369 CN1C(=O)CCc2c1ccc(c2)O 271570a_203496583355_100000699942 [0,2,0,0,0,0|0,0,2]=4 1460 B14R2.29369 CN1C(=O)COc2c1ccc(c2)O 271570a_203496583355_100010240413 [0,2,0,0,0,0|1,0,1]=4 1461 B14R2.29369 Cc1ccc2c(c(ccc2n1)F)O 271570a_203496583355_100010730238 [0,2,0,0,0,0|1,0,1]=4 1462 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [0,2,0,0,0,0|1,0,1]=4 1463 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [0,2,0,0,0,0|1,0,0]=3 1464 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [0,2,0,0,0,0|1,0,1]=4 1465 B14R2.112 C=C=Cc1ccc2ccccc2c1 271570a_100015277604_100000233703 [0,2,0,0,0,0|2,0,0]=4 1466 B14R2.112 C=C=Cc1ccc2ccccc2n1 271570a_100015277604_100011291633 [0,2,0,0,0,0|1,0,1]=4 1467 B14R2.112 CC=Cc1ccc2ccccc2c1 271570a_100016259895_100000233703 [0,2,0,0,0,0|2,0,0]=4 1468 B14R2.112 CC=Cc1ccc2ccccc2n1 271570a_100016259895_100011291633 [0,2,0,0,0,0|1,0,1]=4 1469 B14R2.112 CCNc1ccc2ccccc2c1 34a_100000211940_100000210202 [0,2,0,0,0,0|2,0,0]=4 1470 B14R2.112 CCNc1ccc2ccccc2c1 7a_100000211940_100000210202 [0,2,0,0,0,0|2,0,0]=4 1471 B14R2.112 CCNc1ccc2ccccc2n1 27a_100015525214_100011291633 [0,2,0,0,0,0|1,0,1]=4 1472 B14R2.112 CCOc1ccc2ccccc2c1 34a_100000185828_100000210202 [0,2,0,0,0,0|1,0,1]=4 1473 B14R2.112 CCOc1ccc2ccccc2c1 7a_100000185828_100000210202 [0,2,0,0,0,0|1,0,1]=4 1474 B14R2.112 CCSc1ccc2ccccc2c1 62a_100000210202_100000233703 [0,2,0,0,0,0|1,1,0]=4 1475 B14R2.112 CCSc1ccc2ccccc2n1 62a_100000210202_100011291633 [0,2,0,0,0,0|0,1,1]=4 1476 B14R2.112 CCSc1ccc2ccccc2n1 62a_100011291633_100000210202 [0,2,0,0,0,0|0,1,1]=4 1477 B14R2.112 CNCc1ccc2ccccc2c1 207a_100102657272_100000211584 [0,2,0,0,0,0|2,0,0]=4 1478 B14R2.112 CNCc1ccc2ccccc2c1 2230a_100000739491_200000210301 [0,2,0,0,0,0|2,0,0]=4 1479 B14R2.112 CNCc1ccc2ccccc2c1 2230a_106832991635_100011216711 [0,2,0,0,0,0|2,0,0]=4 1480 B14R2.112 CNCc1ccc2ccccc2c1 270004a_106832991635_100000211584 [0,2,0,0,0,0|2,0,0]=4 1481 B14R2.112 CNCc1ccc2ccccc2c1 34a_100000739491_200000210301 [0,2,0,0,0,0|2,0,0]=4 1482 B14R2.112 CNCc1ccc2ccccc2c1 34a_100102657272_100011216711 [0,2,0,0,0,0|2,0,0]=4 1483 B14R2.112 CNCc1ccc2ccccc2c1 7a_106832991635_100011216711 [0,2,0,0,0,0|2,0,0]=4 1484 B14R2.112 CNCc1ccc2ccccc2n1 207a_100102657272_100000759686 [0,2,0,0,0,0|1,0,1]=4 1485 B14R2.112 CNCc1ccc2ccccc2n1 2230a_106832991635_100000737579 [0,2,0,0,0,0|1,0,1]=4 1486 B14R2.112 CNCc1ccc2ccccc2n1 270004a_106832991635_100000759686 [0,2,0,0,0,0|1,0,1]=4 1487 B14R2.112 CNCc1ccc2ccccc2n1 34a_100102657272_100000737579 [0,2,0,0,0,0|1,0,1]=4 1488 B14R2.112 CNCc1ccc2ccccc2n1 7a_106832991635_100000737579 [0,2,0,0,0,0|1,0,1]=4 1489 B14R2.112 COCc1ccc2ccccc2c1 34a_100011215330_200000210301 [0,2,0,0,0,0|1,0,1]=4 1490 B14R2.112 COCc1ccc2ccccc2c1 34a_100138415774_100011216711 [0,2,0,0,0,0|1,0,1]=4 1491 B14R2.112 COCc1ccc2ccccc2c1 7a_100011215330_200000210301 [0,2,0,0,0,0|1,0,1]=4 1492 B14R2.112 COCc1ccc2ccccc2n1 34a_100138415774_100000737579 [0,2,0,0,0,0|0,0,2]=4 1493 B14R2.112 CSCc1ccc2ccccc2c1 62a_100011216711_200000210301 [0,2,0,0,0,0|1,1,0]=4 1494 B14R2.112 CSCc1ccc2ccccc2c1 62a_200000210301_100011216711 [0,2,0,0,0,0|1,1,0]=4 1495 B14R2.112 CSCc1ccc2ccccc2n1 62a_100000737579_200000210301 [0,2,0,0,0,0|0,1,1]=4 1496 B14R2.112 CSCc1ccc2ccccc2n1 62a_200000210301_100000737579 [0,2,0,0,0,0|0,1,1]=4 1497 B14R2.112 FCNc1ccc2ccccc2c1 34a_100000211940_100015361967 [0,2,0,0,0,0|2,0,0]=4 1498 B14R2.112 FCNc1ccc2ccccc2c1 7a_100000211940_100015361967 [0,2,0,0,0,0|2,0,0]=4 1499 B14R2.112 FCOc1ccc2ccccc2c1 34a_100000185828_100015361967 [0,2,0,0,0,0|1,0,1]=4 1500 B14R2.112 FCOc1ccc2ccccc2c1 7a_100000185828_100015361967 [0,2,0,0,0,0|1,0,1]=4 1501 B14R2.112 FCSc1ccc2ccccc2c1 62a_100015361967_100000233703 [0,2,0,0,0,0|1,1,0]=4 1502 B14R2.112 FCSc1ccc2ccccc2n1 62a_100011291633_100015361967 [0,2,0,0,0,0|0,1,1]=4 1503 B14R2.112 FCSc1ccc2ccccc2n1 62a_100015361967_100011291633 [0,2,0,0,0,0|0,1,1]=4 1504 B14R2.112 [13CH3]NCc1ccc2ccccc2c1 2230a_100000739491_200025704644 [0,2,0,0,0,0|2,0,0]=4 1505 B14R2.112 [13CH3]NCc1ccc2ccccc2c1 34a_100000739491_200025704644 [0,2,0,0,0,0|2,0,0]=4 1506 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 34a_100011215330_200025704644 [0,2,0,0,0,0|1,0,1]=4 1507 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 7a_100011215330_200025704644 [0,2,0,0,0,0|1,0,1]=4 1508 B14R2.112 [13CH3]SCc1ccc2ccccc2c1 62a_100011216711_200025704644 [0,2,0,0,0,0|1,1,0]=4 1509 B14R2.112 [13CH3]SCc1ccc2ccccc2c1 62a_200025704644_100011216711 [0,2,0,0,0,0|1,1,0]=4 1510 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_100000737579_200025704644 [0,2,0,0,0,0|0,1,1]=4 1511 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_200025704644_100000737579 [0,2,0,0,0,0|0,1,1]=4 1512 B14R2.134 C=Cc1cc2[nH]c(=O)ccc2cn1 271570a_100011290941_100010563892 [0,2,0,0,0,0|1,0,0]=3 1513 B14R2.134 C=Cc1ccc2c(c1)NC(=O)CC2 271570a_100011290941_100000763451 [0,2,0,0,0,0|0,0,2]=4 1514 B14R2.134 C=Cc1ccc2c(c1)NC(=O)CO2 271570a_100011290941_100000244627 [0,2,0,0,0,0|1,0,1]=4 1515 B14R2.134 C=Cc1ccc2c(c1)NC(=O)CS2 271570a_100011290941_100012361575 [0,2,0,0,0,0|1,0,1]=4 1516 B14R2.134 C=Cc1ccc2c(c1)NC(=O)NC2 271570a_100011290941_100010161048 [0,2,0,0,0,0|1,0,1]=4 1517 B14R2.134 C=Cc1ccc2c(c1)NC(=O)OC2 271570a_100011290941_100000726308 [0,2,0,0,0,0|1,0,1]=4 1518 B14R2.134 C=Cc1ccc2ccc(=O)oc2c1 271570a_100011290941_100009993525 [0,2,0,0,0,0|1,0,0]=3 1519 B14R2.134 C=Cc1ccc2ccc(cc2c1)N 271570a_100011290941_100010090036 [0,2,0,0,0,0|2,0,0]=4 1520 B14R2.134 C=Cc1ccc2ccc(cc2c1)O 271570a_100011290941_100009816537 [0,2,0,0,0,0|1,0,1]=4 1521 B14R2.134 C=Cc1ccc2ccc(cc2n1)O 271570a_100011290941_100000079174 [0,2,0,0,0,0|1,0,1]=4 1522 B14R2.134 C=Cc1ccc2ccc(nc2c1)C 271570a_100011290941_100009817087 [0,2,0,0,0,0|1,0,1]=4 1523 B14R2.134 C=Cc1ccc2ccc(nc2c1)N 271570a_100011290941_100010187616 [0,2,0,0,0,0|1,0,1]=4 1524 B14R2.134 C=Cc1ccc2ccc(nc2c1)O 271570a_100011290941_100000690401 [0,2,0,0,0,0|0,0,2]=4 1525 B14R2.134 CNc1cc2[nH]c(=O)ccc2cn1 27a_100102657272_100010563892 [0,2,0,0,0,0|1,0,0]=3 1526 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200000210301 [0,2,0,0,0,0|0,0,2]=4 1527 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200000210301 [0,2,0,0,0,0|0,0,2]=4 1528 B14R2.134 CNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200000210301 [0,2,0,0,0,0|1,0,1]=4 1529 B14R2.134 CNc1ccc2ccc(cc2c1)Br 34a_100010090036_200000210301 [0,2,0,0,0,0|2,0,0]=4 1530 B14R2.134 CNc1ccc2ccc(cc2c1)Br 7a_100010090036_200000210301 [0,2,0,0,0,0|2,0,0]=4 1531 B14R2.134 CNc1ccc2ccc(cc2c1)O 34a_100015378740_200000210301 [0,2,0,0,0,0|1,0,1]=4 1532 B14R2.134 CNc1ccc2ccc(cc2c1)O 7a_100015378740_200000210301 [0,2,0,0,0,0|1,0,1]=4 1533 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200000210301 [0,2,0,0,0,0|0,0,2]=4 1534 B14R2.134 COc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200000210301 [0,2,0,0,0,0|1,0,1]=4 1535 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [0,2,0,0,0,0|1,0,0]=3 1536 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [0,2,0,0,0,0|1,0,0]=3 1537 B14R2.134 COc1ccc2ccc(cc2c1)Br 34a_100009816537_200000210301 [0,2,0,0,0,0|1,0,1]=4 1538 B14R2.134 COc1ccc2ccc(cc2c1)Br 7a_100009816537_200000210301 [0,2,0,0,0,0|1,0,1]=4 1539 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [0,2,0,0,0,0|1,0,1]=4 1540 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [0,2,0,0,0,0|1,0,1]=4 1541 B14R2.134 COc1ccc2ccc(cc2c1)N 34a_100015378740_200000210301 [0,2,0,0,0,0|1,0,1]=4 1542 B14R2.134 COc1ccc2ccc(cc2c1)N 7a_100015378740_200000210301 [0,2,0,0,0,0|1,0,1]=4 1543 B14R2.134 COc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090027 [0,2,0,0,0,0|1,0,1]=4 1544 B14R2.134 COc1ccc2ccc(cc2n1)O 271570a_203496583355_100010248626 [0,2,0,0,0,0|0,0,2]=4 1545 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [0,2,0,0,0,0|1,0,1]=4 1546 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [0,2,0,0,0,0|1,0,1]=4 1547 B14R2.134 COc1ccc2ccc(nc2c1)Cl 34a_100000079174_200000210301 [0,2,0,0,0,0|1,0,1]=4 1548 B14R2.134 COc1ccc2ccc(nc2c1)Cl 7a_100000079174_200000210301 [0,2,0,0,0,0|1,0,1]=4 1549 B14R2.134 COc1ccc2ccc(nc2c1)O 271570a_203496583355_100009877240 [0,2,0,0,0,0|0,0,2]=4 1550 B14R2.134 CSc1cc2[nH]c(=O)ccc2cn1 62a_200000210301_100010563892 [0,2,0,0,0,0|1,0,0]=3 1551 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200000210301 [0,2,0,0,0,0|0,0,2]=4 1552 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_200000210301_100000763451 [0,2,0,0,0,0|0,0,2]=4 1553 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200000210301 [0,2,0,0,0,0|1,0,1]=4 1554 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_200000210301_100010161048 [0,2,0,0,0,0|1,0,1]=4 1555 B14R2.134 CSc1ccc2ccc(=O)oc2c1 62a_200000210301_100009993525 [0,2,0,0,0,0|1,0,0]=3 1556 B14R2.134 CSc1ccc2ccc(cc2c1)N 62a_100010090036_200000210301 [0,2,0,0,0,0|1,1,0]=4 1557 B14R2.134 CSc1ccc2ccc(cc2c1)N 62a_200000210301_100010090036 [0,2,0,0,0,0|1,1,0]=4 1558 B14R2.134 CSc1ccc2ccc(cc2c1)O 62a_200000210301_100009816537 [0,2,0,0,0,0|1,0,1]=4 1559 B14R2.134 CSc1ccc2ccc(cc2n1)O 62a_200000210301_100000079174 [0,2,0,0,0,0|0,1,1]=4 1560 B14R2.134 CSc1ccc2ccc(nc2c1)C 62a_100009817087_200000210301 [0,2,0,0,0,0|1,0,1]=4 1561 B14R2.134 CSc1ccc2ccc(nc2c1)C 62a_200000210301_100009817087 [0,2,0,0,0,0|1,0,1]=4 1562 B14R2.134 CSc1ccc2ccc(nc2c1)N 62a_100010187616_200000210301 [0,2,0,0,0,0|1,0,1]=4 1563 B14R2.134 CSc1ccc2ccc(nc2c1)O 62a_200000210301_100000690401 [0,2,0,0,0,0|0,0,2]=4 1564 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [0,2,0,0,0,0|1,0,1]=4 1565 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [0,2,0,0,0,0|1,0,1]=4 1566 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [0,2,0,0,0,0|1,0,1]=4 1567 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [0,2,0,0,0,0|1,0,1]=4 1568 B14R2.134 Cc1ccc2ccc(cc2n1)S[13CH3] 62a_100009817087_200025704644 [0,2,0,0,0,0|1,0,1]=4 1569 B14R2.134 Cc1ccc2ccc(cc2n1)S[13CH3] 62a_200025704644_100009817087 [0,2,0,0,0,0|1,0,1]=4 1570 B14R2.134 O=Cc1ccc2ccc(cc2c1)O 271570a_203496583355_100010200085 [0,2,0,0,0,0|1,0,0]=3 1571 B14R2.134 O=Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100010174008 [0,2,0,0,0,0|2,0,0]=4 1572 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200025704644 [0,2,0,0,0,0|0,0,2]=4 1573 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200025704644 [0,2,0,0,0,0|0,0,2]=4 1574 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200025704644 [0,2,0,0,0,0|1,0,1]=4 1575 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)Br 34a_100010090036_200025704644 [0,2,0,0,0,0|2,0,0]=4 1576 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)Br 7a_100010090036_200025704644 [0,2,0,0,0,0|2,0,0]=4 1577 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 34a_100015378740_200025704644 [0,2,0,0,0,0|1,0,1]=4 1578 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 7a_100015378740_200025704644 [0,2,0,0,0,0|1,0,1]=4 1579 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200025704644 [0,2,0,0,0,0|0,0,2]=4 1580 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200025704644 [0,2,0,0,0,0|1,0,1]=4 1581 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [0,2,0,0,0,0|1,0,0]=3 1582 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [0,2,0,0,0,0|1,0,0]=3 1583 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 34a_100009816537_200025704644 [0,2,0,0,0,0|1,0,1]=4 1584 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 7a_100009816537_200025704644 [0,2,0,0,0,0|1,0,1]=4 1585 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 34a_100015378740_200025704644 [0,2,0,0,0,0|1,0,1]=4 1586 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 7a_100015378740_200025704644 [0,2,0,0,0,0|1,0,1]=4 1587 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_200025704644 [0,2,0,0,0,0|1,0,1]=4 1588 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_200025704644 [0,2,0,0,0,0|1,0,1]=4 1589 B14R2.134 [13CH3]Sc1cc2[nH]c(=O)ccc2cn1 62a_200025704644_100010563892 [0,2,0,0,0,0|1,0,0]=3 1590 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200025704644 [0,2,0,0,0,0|0,0,2]=4 1591 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_200025704644_100000763451 [0,2,0,0,0,0|0,0,2]=4 1592 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200025704644 [0,2,0,0,0,0|1,0,1]=4 1593 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_200025704644_100010161048 [0,2,0,0,0,0|1,0,1]=4 1594 B14R2.134 [13CH3]Sc1ccc2ccc(=O)oc2c1 62a_200025704644_100009993525 [0,2,0,0,0,0|1,0,0]=3 1595 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)N 62a_100010090036_200025704644 [0,2,0,0,0,0|1,1,0]=4 1596 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)N 62a_200025704644_100010090036 [0,2,0,0,0,0|1,1,0]=4 1597 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)O 62a_200025704644_100009816537 [0,2,0,0,0,0|1,0,1]=4 1598 B14R2.134 [13CH3]Sc1ccc2ccc(cc2n1)O 62a_200025704644_100000079174 [0,2,0,0,0,0|0,1,1]=4 1599 B14R2.134 [13CH3]Sc1ccc2ccc(nc2c1)N 62a_100010187616_200025704644 [0,2,0,0,0,0|1,0,1]=4 1600 B14R2.134 [13CH3]Sc1ccc2ccc(nc2c1)O 62a_200025704644_100000690401 [0,2,0,0,0,0|0,0,2]=4 1601 B14R2.142 C=Cc1ccc2cccc(c2c1)C 271570a_100011290941_100010089936 [0,2,0,0,0,0|2,0,0]=4 1602 B14R2.142 C=Cc1ccc2cccc(c2c1)N 271570a_100011290941_100010090012 [0,2,0,0,0,0|2,0,0]=4 1603 B14R2.142 C=Cc1ccc2cccc(c2c1)O 271570a_100011290941_100010089991 [0,2,0,0,0,0|2,0,0]=4 1604 B14R2.142 C=Cc1ccc2cccc(c2n1)C 271570a_100011290941_100012002297 [0,2,0,0,0,0|1,0,1]=4 1605 B14R2.142 C=Cc1ccc2cccc(c2n1)F 271570a_100011290941_100012017632 [0,2,0,0,0,0|1,0,1]=4 1606 B14R2.142 C=Cc1ccc2cccc(c2n1)O 271570a_100011290941_100010153751 [0,2,0,0,0,0|1,0,1]=4 1607 B14R2.142 CNc1ccc2cccc(c2c1)O 34a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1608 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [0,2,0,0,0,0|1,0,1]=4 1609 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [0,2,0,0,0,0|1,0,1]=4 1610 B14R2.142 COc1ccc2cccc(c2c1)Br 34a_100010169565_200000210301 [0,2,0,0,0,0|1,0,1]=4 1611 B14R2.142 COc1ccc2cccc(c2c1)Br 7a_100010169565_200000210301 [0,2,0,0,0,0|1,0,1]=4 1612 B14R2.142 COc1ccc2cccc(c2c1)C 34a_200000091600_200000210301 [0,2,0,0,0,0|1,0,1]=4 1613 B14R2.142 COc1ccc2cccc(c2c1)C 7a_200000091600_200000210301 [0,2,0,0,0,0|1,0,1]=4 1614 B14R2.142 COc1ccc2cccc(c2c1)F 34a_100000091619_200000210301 [0,2,0,0,0,0|1,0,1]=4 1615 B14R2.142 COc1ccc2cccc(c2c1)F 7a_100000091619_200000210301 [0,2,0,0,0,0|1,0,1]=4 1616 B14R2.142 COc1ccc2cccc(c2c1)N 34a_100000034012_200000210301 [0,2,0,0,0,0|1,0,1]=4 1617 B14R2.142 COc1ccc2cccc(c2c1)N 7a_100000034012_200000210301 [0,2,0,0,0,0|1,0,1]=4 1618 B14R2.142 COc1ccc2cccc(c2c1)O 271570a_203496583355_100010178974 [0,2,0,0,0,0|1,0,1]=4 1619 B14R2.142 CSc1ccc2cccc(c2c1)C 62a_200000210301_100010089936 [0,2,0,0,0,0|1,1,0]=4 1620 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_100010090012_200000210301 [0,2,0,0,0,0|1,1,0]=4 1621 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_200000210301_100010090012 [0,2,0,0,0,0|1,1,0]=4 1622 B14R2.142 CSc1ccc2cccc(c2c1)O 62a_200000210301_100010089991 [0,2,0,0,0,0|1,1,0]=4 1623 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [0,2,0,0,0,0|0,1,1]=4 1624 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [0,2,0,0,0,0|0,1,1]=4 1625 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [0,2,0,0,0,0|0,1,1]=4 1626 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 34a_200000091600_200025704644 [0,2,0,0,0,0|1,0,1]=4 1627 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 7a_200000091600_200025704644 [0,2,0,0,0,0|1,0,1]=4 1628 B14R2.142 Cc1cccc2c1cc(cc2)S[13CH3] 62a_200025704644_100010089936 [0,2,0,0,0,0|1,1,0]=4 1629 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [0,2,0,0,0,0|0,1,1]=4 1630 B14R2.142 O=Cc1ccc2ccnc(c2c1)O 271570a_203496583355_100000094387 [0,2,0,0,0,0|2,0,0]=4 1631 B14R2.142 [13CH3]Nc1ccc2cccc(c2c1)O 34a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 1632 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 34a_100010169565_200025704644 [0,2,0,0,0,0|1,0,1]=4 1633 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 7a_100010169565_200025704644 [0,2,0,0,0,0|1,0,1]=4 1634 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 34a_100000091619_200025704644 [0,2,0,0,0,0|1,0,1]=4 1635 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 7a_100000091619_200025704644 [0,2,0,0,0,0|1,0,1]=4 1636 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 34a_100000034012_200025704644 [0,2,0,0,0,0|1,0,1]=4 1637 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 7a_100000034012_200025704644 [0,2,0,0,0,0|1,0,1]=4 1638 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_100010090012_200025704644 [0,2,0,0,0,0|1,1,0]=4 1639 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_200025704644_100010090012 [0,2,0,0,0,0|1,1,0]=4 1640 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)O 62a_200025704644_100010089991 [0,2,0,0,0,0|1,1,0]=4 1641 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [0,2,0,0,0,0|0,1,1]=4 1642 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [0,2,0,0,0,0|0,1,1]=4 1643 B14R2.781 C=C(C)c1ccc2ccccc2c1 271570a_100000694244_100000233703 [0,2,0,0,0,0|2,0,0]=4 1644 B14R2.781 C=C(C)c1ccc2ccccc2n1 271570a_100000694244_100011291633 [0,2,0,0,0,0|1,0,1]=4 1645 B14R2.781 CC(=O)c1ccc2ccccc2c1 1458a_100000210637_200000210301 [0,2,0,0,0,0|1,0,0]=3 1646 B14R2.781 CC(=O)c1ccc2cccnc2c1 1458a_100011933907_200000210301 [0,2,0,0,0,0|2,0,0]=4 1647 B14R2.781 CC(=O)c1ccc2ccncc2c1 1458a_100000070124_200000210301 [0,2,0,0,0,0|2,0,0]=4 1648 B14R2.781 CC(=O)c1ccc2cnccc2c1 1458a_100011935275_200000210301 [0,2,0,0,0,0|2,0,0]=4 1649 B14R2.781 CC(=O)c1ccc2ncccc2c1 1458a_100011216044_200000210301 [0,2,0,0,0,0|2,0,0]=4 1650 B14R2.781 CN(C)c1ccc2ccccc2c1 2230a_100000181211_200000210301 [0,2,0,0,0,0|2,0,0]=4 1651 B14R2.781 CN(C)c1ccc2ccccc2c1 269982a_100000181211_200000210301 [0,2,0,0,0,0|2,0,0]=4 1652 B14R2.781 CN(C)c1ccc2ccccc2c1 34a_100000181211_200000210301 [0,2,0,0,0,0|2,0,0]=4 1653 B14R2.781 CN(C)c1ccc2ccccc2n1 27a_100102631434_100011291633 [0,2,0,0,0,0|1,0,1]=4 1654 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 2230a_100000181211_200025704644 [0,2,0,0,0,0|2,0,0]=4 1655 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 269982a_100000181211_200025704644 [0,2,0,0,0,0|2,0,0]=4 1656 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 34a_100000181211_200025704644 [0,2,0,0,0,0|2,0,0]=4 1657 B14R2.781 [13CH3]C(=O)c1ccc2ccccc2c1 1458a_100000210637_200025704644 [0,2,0,0,0,0|1,0,0]=3 1658 B14R2.781 [13CH3]C(=O)c1ccc2cccnc2c1 1458a_100011933907_200025704644 [0,2,0,0,0,0|2,0,0]=4 1659 B14R2.781 [13CH3]C(=O)c1ccc2ccncc2c1 1458a_100000070124_200025704644 [0,2,0,0,0,0|2,0,0]=4 1660 B14R2.781 [13CH3]C(=O)c1ccc2cnccc2c1 1458a_100011935275_200025704644 [0,2,0,0,0,0|2,0,0]=4 1661 B14R2.781 [13CH3]C(=O)c1ccc2ncccc2c1 1458a_100011216044_200025704644 [0,2,0,0,0,0|2,0,0]=4 1662 B14R2.1019 C=Cc1cc(=O)c2ccccc2[nH]1 271570a_100011290941_100000090176 [0,2,0,0,0,0|1,0,0]=3 1663 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [0,2,0,0,0,0|2,0,0]=4 1664 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [0,2,0,0,0,0|2,0,0]=4 1665 B14R2.1019 C=Cc1cc(c2ccccc2n1)C 271570a_100011290941_100012354972 [0,2,0,0,0,0|1,0,1]=4 1666 B14R2.1019 C=Cc1cc(c2ccccc2n1)N 271570a_100011290941_100010197925 [0,2,0,0,0,0|1,0,1]=4 1667 B14R2.1019 CNc1cc(c2ccccc2c1)Br 34a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 1668 B14R2.1019 CNc1cc(c2ccccc2c1)Br 7a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 1669 B14R2.1019 CNc1cc(c2ccccc2n1)C 27a_100102657272_100000184993 [0,2,0,0,0,0|1,0,1]=4 1670 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [0,2,0,0,0,0|1,0,1]=4 1671 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [0,2,0,0,0,0|1,0,1]=4 1672 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [0,2,0,0,0,0|1,0,1]=4 1673 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [0,2,0,0,0,0|0,0,2]=4 1674 B14R2.1019 CSc1cc(=O)c2ccccc2[nH]1 62a_200000210301_100000090176 [0,2,0,0,0,0|0,1,0]=3 1675 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_100010171453_200000210301 [0,2,0,0,0,0|1,1,0]=4 1676 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_200000210301_100010171453 [0,2,0,0,0,0|1,1,0]=4 1677 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [0,2,0,0,0,0|1,1,0]=4 1678 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_100012354972_200000210301 [0,2,0,0,0,0|0,1,1]=4 1679 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_200000210301_100000184993 [0,2,0,0,0,0|0,1,1]=4 1680 B14R2.1019 CSc1cc(c2ccccc2n1)N 62a_100010197925_200000210301 [0,2,0,0,0,0|0,1,1]=4 1681 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_100012354972_200025704644 [0,2,0,0,0,0|0,1,1]=4 1682 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_200025704644_100000184993 [0,2,0,0,0,0|0,1,1]=4 1683 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 34a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 1684 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 7a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 1685 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [0,2,0,0,0,0|1,0,1]=4 1686 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [0,2,0,0,0,0|1,0,1]=4 1687 B14R2.1019 [13CH3]Sc1cc(=O)c2ccccc2[nH]1 62a_200025704644_100000090176 [0,2,0,0,0,0|0,1,0]=3 1688 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_100010171453_200025704644 [0,2,0,0,0,0|1,1,0]=4 1689 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_200025704644_100010171453 [0,2,0,0,0,0|1,1,0]=4 1690 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [0,2,0,0,0,0|1,1,0]=4 1691 B14R2.1019 [13CH3]Sc1cc(c2ccccc2n1)N 62a_100010197925_200025704644 [0,2,0,0,0,0|0,1,1]=4 1692 B14R2.1128 C=Cc1cc2ccccc2cc1Br 271570a_100011290941_200010169544 [0,2,0,0,0,0|2,0,0]=4 1693 B14R2.1128 C=Cc1cc2ccccc2cc1Cl 271570a_100011290941_100010152806 [0,2,0,0,0,0|2,0,0]=4 1694 B14R2.1128 C=Cc1cc2ccccc2cc1N 271570a_100011290941_100009991566 [0,2,0,0,0,0|2,0,0]=4 1695 B14R2.1128 C=Cc1cc2ccccc2cc1O 271570a_100011290941_100009817189 [0,2,0,0,0,0|1,0,1]=4 1696 B14R2.1128 C=Cc1cc2ccccc2nc1Cl 271570a_100011290941_100010220712 [0,2,0,0,0,0|1,0,1]=4 1697 B14R2.1128 C=Cc1cc2ccccc2nc1F 271570a_100011290941_100011158909 [0,2,0,0,0,0|1,0,1]=4 1698 B14R2.1128 C=Cc1cc2ccccc2nc1N 271570a_100011290941_100010135404 [0,2,0,0,0,0|1,0,1]=4 1699 B14R2.1128 C=Cc1cc2ccccc2nc1O 271570a_100011290941_200009820883 [0,2,0,0,0,0|0,0,2]=4 1700 B14R2.1128 C=Cc1cc2ccccc2oc1=O 271570a_100011290941_200000187772 [0,2,0,0,0,0|1,0,0]=3 1701 B14R2.1128 C=Cc1nc2ccccc2cc1Br 271570a_100011290941_100010072790 [0,2,0,0,0,0|1,0,1]=4 1702 B14R2.1128 C=Cc1nc2ccccc2cc1C 271570a_100011290941_100000751756 [0,2,0,0,0,0|1,0,1]=4 1703 B14R2.1128 C=Cc1nc2ccccc2cc1O 271570a_100011290941_200000100762 [0,2,0,0,0,0|1,0,1]=4 1704 B14R2.1128 CCc1cc2ccccc2nc1O 271570a_203496583355_100011829826 [0,2,0,0,0,0|0,0,2]=4 1705 B14R2.1128 CNc1cc2ccccc2cc1Br 34a_100009991566_200000210301 [0,2,0,0,0,0|2,0,0]=4 1706 B14R2.1128 CNc1cc2ccccc2cc1Br 7a_100009991566_200000210301 [0,2,0,0,0,0|2,0,0]=4 1707 B14R2.1128 CNc1nc2ccccc2cc1C 27a_100102657272_100000751756 [0,2,0,0,0,0|1,0,1]=4 1708 B14R2.1128 COc1cc2ccccc2cc1Br 34a_100009817189_200000210301 [0,2,0,0,0,0|1,0,1]=4 1709 B14R2.1128 COc1cc2ccccc2cc1Br 7a_100009817189_200000210301 [0,2,0,0,0,0|1,0,1]=4 1710 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [0,2,0,0,0,0|1,0,1]=4 1711 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [0,2,0,0,0,0|1,0,1]=4 1712 B14R2.1128 COc1cc2ccccc2cc1N 34a_106744474703_200000210301 [0,2,0,0,0,0|1,0,1]=4 1713 B14R2.1128 COc1cc2ccccc2cc1N 7a_106744474703_200000210301 [0,2,0,0,0,0|1,0,1]=4 1714 B14R2.1128 COc1cc2ccccc2cc1O 271570a_203496583355_100009817100 [0,2,0,0,0,0|1,0,1]=4 1715 B14R2.1128 COc1cc2ccccc2nc1C 34a_200000079175_200000210301 [0,2,0,0,0,0|1,0,1]=4 1716 B14R2.1128 COc1cc2ccccc2nc1C 7a_200000079175_200000210301 [0,2,0,0,0,0|1,0,1]=4 1717 B14R2.1128 COc1cc2ccccc2nc1Cl 34a_200000100762_200000210301 [0,2,0,0,0,0|1,0,1]=4 1718 B14R2.1128 COc1cc2ccccc2nc1Cl 7a_200000100762_200000210301 [0,2,0,0,0,0|1,0,1]=4 1719 B14R2.1128 COc1cc2ccccc2oc1=O 7a_100000061252_200000210301 [0,2,0,0,0,0|1,0,0]=3 1720 B14R2.1128 COc1nc2ccccc2cc1O 271570a_203496583355_100009820890 [0,2,0,0,0,0|0,0,2]=4 1721 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200000210301_200010169544 [0,2,0,0,0,0|1,1,0]=4 1722 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200010169544_200000210301 [0,2,0,0,0,0|1,1,0]=4 1723 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_100010152806_200000210301 [0,2,0,0,0,0|1,1,0]=4 1724 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_200000210301_100010152806 [0,2,0,0,0,0|1,1,0]=4 1725 B14R2.1128 CSc1cc2ccccc2cc1N 62a_100009991566_200000210301 [0,2,0,0,0,0|1,1,0]=4 1726 B14R2.1128 CSc1cc2ccccc2cc1N 62a_200000210301_100009991566 [0,2,0,0,0,0|1,1,0]=4 1727 B14R2.1128 CSc1cc2ccccc2cc1O 62a_200000210301_100009817189 [0,2,0,0,0,0|1,0,1]=4 1728 B14R2.1128 CSc1cc2ccccc2nc1Cl 62a_200000210301_100010220712 [0,2,0,0,0,0|1,0,1]=4 1729 B14R2.1128 CSc1cc2ccccc2nc1F 62a_100011158909_200000210301 [0,2,0,0,0,0|1,0,1]=4 1730 B14R2.1128 CSc1cc2ccccc2nc1F 62a_200000210301_100011158909 [0,2,0,0,0,0|1,0,1]=4 1731 B14R2.1128 CSc1cc2ccccc2nc1N 62a_100010135404_200000210301 [0,2,0,0,0,0|1,0,1]=4 1732 B14R2.1128 CSc1cc2ccccc2nc1O 62a_200000210301_200009820883 [0,2,0,0,0,0|0,0,2]=4 1733 B14R2.1128 CSc1cc2ccccc2oc1=O 62a_200000210301_200000187772 [0,2,0,0,0,0|1,0,0]=3 1734 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_100010072790_200000210301 [0,2,0,0,0,0|0,1,1]=4 1735 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_200000210301_100010072790 [0,2,0,0,0,0|0,1,1]=4 1736 B14R2.1128 CSc1nc2ccccc2cc1C 62a_200000210301_100000751756 [0,2,0,0,0,0|0,1,1]=4 1737 B14R2.1128 CSc1nc2ccccc2cc1O 62a_200000210301_200000100762 [0,2,0,0,0,0|0,1,1]=4 1738 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [0,2,0,0,0,0|1,0,1]=4 1739 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [0,2,0,0,0,0|1,0,1]=4 1740 B14R2.1128 Cc1cc2ccccc2nc1S[13CH3] 62a_200025704644_100000751756 [0,2,0,0,0,0|0,1,1]=4 1741 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 34a_200000079175_200025704644 [0,2,0,0,0,0|1,0,1]=4 1742 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 7a_200000079175_200025704644 [0,2,0,0,0,0|1,0,1]=4 1743 B14R2.1128 N#Cc1cc2ccccc2nc1O 271570a_203496583355_100015207123 [0,2,0,0,0,0|0,0,2]=4 1744 B14R2.1128 O=Cc1cc2ccccc2nc1O 271570a_203496583355_100000183649 [0,2,0,0,0,0|0,0,2]=4 1745 B14R2.1128 OCc1cc2ccccc2nc1O 271570a_203496583355_100000754719 [0,2,0,0,0,0|0,0,2]=4 1746 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 34a_100009991566_200025704644 [0,2,0,0,0,0|2,0,0]=4 1747 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 7a_100009991566_200025704644 [0,2,0,0,0,0|2,0,0]=4 1748 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 34a_100009817189_200025704644 [0,2,0,0,0,0|1,0,1]=4 1749 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 7a_100009817189_200025704644 [0,2,0,0,0,0|1,0,1]=4 1750 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 34a_106744474703_200025704644 [0,2,0,0,0,0|1,0,1]=4 1751 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 7a_106744474703_200025704644 [0,2,0,0,0,0|1,0,1]=4 1752 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 34a_200000100762_200025704644 [0,2,0,0,0,0|1,0,1]=4 1753 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 7a_200000100762_200025704644 [0,2,0,0,0,0|1,0,1]=4 1754 B14R2.1128 [13CH3]Oc1cc2ccccc2oc1=O 7a_100000061252_200025704644 [0,2,0,0,0,0|1,0,0]=3 1755 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200010169544_200025704644 [0,2,0,0,0,0|1,1,0]=4 1756 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200025704644_200010169544 [0,2,0,0,0,0|1,1,0]=4 1757 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_100010152806_200025704644 [0,2,0,0,0,0|1,1,0]=4 1758 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_200025704644_100010152806 [0,2,0,0,0,0|1,1,0]=4 1759 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_100009991566_200025704644 [0,2,0,0,0,0|1,1,0]=4 1760 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_200025704644_100009991566 [0,2,0,0,0,0|1,1,0]=4 1761 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1O 62a_200025704644_100009817189 [0,2,0,0,0,0|1,0,1]=4 1762 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1Cl 62a_200025704644_100010220712 [0,2,0,0,0,0|1,0,1]=4 1763 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_100011158909_200025704644 [0,2,0,0,0,0|1,0,1]=4 1764 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_200025704644_100011158909 [0,2,0,0,0,0|1,0,1]=4 1765 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1N 62a_100010135404_200025704644 [0,2,0,0,0,0|1,0,1]=4 1766 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1O 62a_200025704644_200009820883 [0,2,0,0,0,0|0,0,2]=4 1767 B14R2.1128 [13CH3]Sc1cc2ccccc2oc1=O 62a_200025704644_200000187772 [0,2,0,0,0,0|1,0,0]=3 1768 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_100010072790_200025704644 [0,2,0,0,0,0|0,1,1]=4 1769 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_200025704644_100010072790 [0,2,0,0,0,0|0,1,1]=4 1770 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1O 62a_200025704644_200000100762 [0,2,0,0,0,0|0,1,1]=4 1771 B14R2.1801 C=Cc1ccc2c(cccc2c1)N 271570a_100011290941_100010090037 [0,2,0,0,0,0|2,0,0]=4 1772 B14R2.1801 C=Cc1ccc2c(cccc2c1)O 271570a_100011290941_100010202202 [0,2,0,0,0,0|2,0,0]=4 1773 B14R2.1801 CNc1ccc2c(cccc2c1)O 34a_100000035793_200000210301 [0,2,0,0,0,0|2,0,0]=4 1774 B14R2.1801 CNc1ccc2c(cccc2c1)O 7a_100000035793_200000210301 [0,2,0,0,0,0|2,0,0]=4 1775 B14R2.1801 COc1ccc2c(cccc2c1)N 34a_100000034668_200000210301 [0,2,0,0,0,0|1,0,1]=4 1776 B14R2.1801 COc1ccc2c(cccc2c1)N 7a_100000034668_200000210301 [0,2,0,0,0,0|1,0,1]=4 1777 B14R2.1801 COc1ccc2c(cccc2c1)O 271570a_203496583355_100010151670 [0,2,0,0,0,0|1,0,1]=4 1778 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_100010090037_200000210301 [0,2,0,0,0,0|1,1,0]=4 1779 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_200000210301_100010090037 [0,2,0,0,0,0|1,1,0]=4 1780 B14R2.1801 CSc1ccc2c(cccc2c1)O 62a_200000210301_100010202202 [0,2,0,0,0,0|1,1,0]=4 1781 B14R2.1801 N#Cc1ccc2c(cccc2c1)O 271570a_203496583355_100010090035 [0,2,0,0,0,0|2,0,0]=4 1782 B14R2.1801 N#Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010235449 [0,2,0,0,0,0|1,0,1]=4 1783 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 34a_100000035793_200025704644 [0,2,0,0,0,0|2,0,0]=4 1784 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 7a_100000035793_200025704644 [0,2,0,0,0,0|2,0,0]=4 1785 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 34a_100000034668_200025704644 [0,2,0,0,0,0|1,0,1]=4 1786 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 7a_100000034668_200025704644 [0,2,0,0,0,0|1,0,1]=4 1787 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_100010090037_200025704644 [0,2,0,0,0,0|1,1,0]=4 1788 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_200025704644_100010090037 [0,2,0,0,0,0|1,1,0]=4 1789 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)O 62a_200025704644_100010202202 [0,2,0,0,0,0|1,1,0]=4 1790 B14R2.2332 C=Cc1ccc2[nH]c(=O)ccc2c1 271570a_100011290941_100011934725 [0,2,0,0,0,0|0,0,0]=2 1791 B14R2.2332 C=Cc1ccc2[nH]c(=O)cnc2c1 271570a_100011290941_100010209493 [0,2,0,0,0,0|1,0,0]=3 1792 B14R2.2332 C=Cc1ccc2c(c1)CCC(=O)N2 271570a_100011290941_100000754843 [0,2,0,0,0,0|0,0,2]=4 1793 B14R2.2332 C=Cc1ccc2c(c1)CNC(=O)N2 271570a_100011290941_100010171468 [0,2,0,0,0,0|1,0,1]=4 1794 B14R2.2332 C=Cc1ccc2c(c1)COC(=O)N2 271570a_100011290941_100010219366 [0,2,0,0,0,0|1,0,1]=4 1795 B14R2.2332 C=Cc1ccc2c(c1)NCC(=O)N2 271570a_100011290941_100000693460 [0,2,0,0,0,0|1,0,1]=4 1796 B14R2.2332 C=Cc1ccc2c(c1)OCC(=O)N2 271570a_100011290941_100000745508 [0,2,0,0,0,0|1,0,1]=4 1797 B14R2.2332 C=Cc1ccc2c(c1)SCC(=O)N2 271570a_100011290941_100011830382 [0,2,0,0,0,0|1,0,1]=4 1798 B14R2.2332 C=Cc1ccc2cc(ccc2c1)Br 271570a_100011290941_100012344972 [0,2,0,0,0,0|2,0,0]=4 1799 B14R2.2332 C=Cc1ccc2cc(ccc2c1)F 271570a_100011290941_100009817052 [0,2,0,0,0,0|2,0,0]=4 1800 B14R2.2332 C=Cc1ccc2cc(ccc2c1)N 271570a_100011290941_100000185457 [0,2,0,0,0,0|2,0,0]=4 1801 B14R2.2332 C=Cc1ccc2cc(ccc2c1)O 271570a_100011290941_100000185455 [0,2,0,0,0,0|1,0,1]=4 1802 B14R2.2332 C=Cc1ccc2cc(ccc2n1)C 271570a_100011290941_100011865911 [0,2,0,0,0,0|1,0,1]=4 1803 B14R2.2332 C=Cc1ccc2cc(ccc2n1)F 271570a_100011290941_100011998705 [0,2,0,0,0,0|1,0,1]=4 1804 B14R2.2332 C=Cc1ccc2cc(ccc2n1)O 271570a_100011290941_100009849208 [0,2,0,0,0,0|1,0,1]=4 1805 B14R2.2332 C=Cc1ccc2nc(ccc2c1)C 271570a_100011290941_100000686635 [0,2,0,0,0,0|1,0,1]=4 1806 B14R2.2332 C=Cc1ccc2nc(ccc2c1)Cl 271570a_100011290941_200012034268 [0,2,0,0,0,0|1,0,1]=4 1807 B14R2.2332 C=Cc1ccc2nc(ccc2c1)N 271570a_100011290941_100011934619 [0,2,0,0,0,0|1,0,1]=4 1808 B14R2.2332 C=Cc1ccc2oc(=O)ccc2c1 271570a_100011290941_100009999946 [0,2,0,0,0,0|1,0,0]=3 1809 B14R2.2332 C=Cc1cnc2[nH]c(=O)cnc2c1 271570a_100011290941_200010159638 [0,2,0,0,0,0|2,0,0]=4 1810 B14R2.2332 CNc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200000210301 [0,2,0,0,0,0|0,0,2]=4 1811 B14R2.2332 CNc1ccc2cc(ccc2c1)Br 34a_100000185457_200000210301 [0,2,0,0,0,0|2,0,0]=4 1812 B14R2.2332 CNc1ccc2cc(ccc2c1)Br 7a_100000185457_200000210301 [0,2,0,0,0,0|2,0,0]=4 1813 B14R2.2332 CNc1ccc2cc(ccc2n1)C 27a_100102657272_100011865911 [0,2,0,0,0,0|1,0,1]=4 1814 B14R2.2332 CNc1ccc2cc(ccc2n1)F 27a_100102657272_100011998705 [0,2,0,0,0,0|1,0,1]=4 1815 B14R2.2332 CNc1ccc2cc(ccc2n1)O 271570a_203496583355_200012034361 [0,2,0,0,0,0|1,0,1]=4 1816 B14R2.2332 CNc1ccc2nc(ccc2c1)C 34a_100011216442_200000210301 [0,2,0,0,0,0|1,0,1]=4 1817 B14R2.2332 CNc1ccc2oc(=O)ccc2c1 7a_100000008519_200000210301 [0,2,0,0,0,0|1,0,0]=3 1818 B14R2.2332 COc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200000210301 [0,2,0,0,0,0|0,0,2]=4 1819 B14R2.2332 COc1ccc2cc(ccc2c1)Br 34a_100000185455_200000210301 [0,2,0,0,0,0|1,0,1]=4 1820 B14R2.2332 COc1ccc2cc(ccc2c1)Br 7a_100000185455_200000210301 [0,2,0,0,0,0|1,0,1]=4 1821 B14R2.2332 COc1ccc2cc(ccc2c1)C 34a_100000074090_200000210301 [0,2,0,0,0,0|1,0,1]=4 1822 B14R2.2332 COc1ccc2cc(ccc2c1)C 7a_100000074090_200000210301 [0,2,0,0,0,0|1,0,1]=4 1823 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 34a_100000074905_200000210301 [0,2,0,0,0,0|1,0,1]=4 1824 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 7a_100000074905_200000210301 [0,2,0,0,0,0|1,0,1]=4 1825 B14R2.2332 COc1ccc2cc(ccc2c1)F 34a_100009847029_200000210301 [0,2,0,0,0,0|1,0,1]=4 1826 B14R2.2332 COc1ccc2cc(ccc2c1)F 7a_100009847029_200000210301 [0,2,0,0,0,0|1,0,1]=4 1827 B14R2.2332 COc1ccc2cc(ccc2c1)O 271570a_203496583355_100000170439 [0,2,0,0,0,0|1,0,1]=4 1828 B14R2.2332 COc1ccc2cc(ccc2n1)O 271570a_203496583355_100009817092 [0,2,0,0,0,0|0,0,2]=4 1829 B14R2.2332 COc1ccc2nc(ccc2c1)C 34a_100000037634_200000210301 [0,2,0,0,0,0|1,0,1]=4 1830 B14R2.2332 COc1ccc2nc(ccc2c1)C 7a_100000037634_200000210301 [0,2,0,0,0,0|1,0,1]=4 1831 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 34a_100009849208_200000210301 [0,2,0,0,0,0|1,0,1]=4 1832 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 7a_100009849208_200000210301 [0,2,0,0,0,0|1,0,1]=4 1833 B14R2.2332 COc1ccc2nc(ccc2c1)O 271570a_203496583355_100000743015 [0,2,0,0,0,0|0,0,2]=4 1834 B14R2.2332 COc1ccc2oc(=O)ccc2c1 34a_100000066265_200000210301 [0,2,0,0,0,0|1,0,0]=3 1835 B14R2.2332 COc1ccc2oc(=O)ccc2c1 7a_100000066265_200000210301 [0,2,0,0,0,0|1,0,0]=3 1836 B14R2.2332 CSc1ccc2[nH]c(=O)ccc2c1 62a_200000210301_100011934725 [0,2,0,0,0,0|0,0,0]=2 1837 B14R2.2332 CSc1ccc2[nH]c(=O)cnc2c1 62a_200000210301_100010209493 [0,2,0,0,0,0|1,0,0]=3 1838 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200000210301 [0,2,0,0,0,0|0,0,2]=4 1839 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_200000210301_100000754843 [0,2,0,0,0,0|0,0,2]=4 1840 B14R2.2332 CSc1ccc2c(c1)CNC(=O)N2 62a_200000210301_100010171468 [0,2,0,0,0,0|1,0,1]=4 1841 B14R2.2332 CSc1ccc2c(c1)NCC(=O)N2 62a_200000210301_100000693460 [0,2,0,0,0,0|1,0,1]=4 1842 B14R2.2332 CSc1ccc2cc(ccc2c1)Br 62a_100012344972_200000210301 [0,2,0,0,0,0|1,1,0]=4 1843 B14R2.2332 CSc1ccc2cc(ccc2c1)Br 62a_200000210301_100012344972 [0,2,0,0,0,0|1,1,0]=4 1844 B14R2.2332 CSc1ccc2cc(ccc2c1)F 62a_100009817052_200000210301 [0,2,0,0,0,0|1,1,0]=4 1845 B14R2.2332 CSc1ccc2cc(ccc2c1)F 62a_200000210301_100009817052 [0,2,0,0,0,0|1,1,0]=4 1846 B14R2.2332 CSc1ccc2cc(ccc2c1)N 62a_100000185457_200000210301 [0,2,0,0,0,0|1,1,0]=4 1847 B14R2.2332 CSc1ccc2cc(ccc2c1)N 62a_200000210301_100000185457 [0,2,0,0,0,0|1,1,0]=4 1848 B14R2.2332 CSc1ccc2cc(ccc2c1)O 62a_200000210301_100000185455 [0,2,0,0,0,0|1,0,1]=4 1849 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000181977_200000210301 [0,2,0,0,0,0|0,1,1]=4 1850 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000210301_100011865911 [0,2,0,0,0,0|0,1,1]=4 1851 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200000210301_100011998705 [0,2,0,0,0,0|0,1,1]=4 1852 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200012355665_200000210301 [0,2,0,0,0,0|0,1,1]=4 1853 B14R2.2332 CSc1ccc2cc(ccc2n1)O 62a_200000210301_100009849208 [0,2,0,0,0,0|0,1,1]=4 1854 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_100000686635_200000210301 [0,2,0,0,0,0|1,0,1]=4 1855 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_200000210301_100000686635 [0,2,0,0,0,0|1,0,1]=4 1856 B14R2.2332 CSc1ccc2nc(ccc2c1)Cl 62a_200000210301_200012034268 [0,2,0,0,0,0|1,0,1]=4 1857 B14R2.2332 CSc1ccc2nc(ccc2c1)N 62a_100011934619_200000210301 [0,2,0,0,0,0|1,0,1]=4 1858 B14R2.2332 CSc1ccc2oc(=O)ccc2c1 62a_200000210301_100009999946 [0,2,0,0,0,0|1,0,0]=3 1859 B14R2.2332 CSc1cnc2[nH]c(=O)cnc2c1 62a_200000210301_200010159638 [0,2,0,0,0,0|2,0,0]=4 1860 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 34a_100000074090_200025704644 [0,2,0,0,0,0|1,0,1]=4 1861 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 7a_100000074090_200025704644 [0,2,0,0,0,0|1,0,1]=4 1862 B14R2.2332 Cc1ccc2cc(ccc2n1)N[13CH3] 34a_100011216442_200025704644 [0,2,0,0,0,0|1,0,1]=4 1863 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 34a_100000037634_200025704644 [0,2,0,0,0,0|1,0,1]=4 1864 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 7a_100000037634_200025704644 [0,2,0,0,0,0|1,0,1]=4 1865 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_100000686635_200025704644 [0,2,0,0,0,0|1,0,1]=4 1866 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_200025704644_100000686635 [0,2,0,0,0,0|1,0,1]=4 1867 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200000181977_200025704644 [0,2,0,0,0,0|0,1,1]=4 1868 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200025704644_100011865911 [0,2,0,0,0,0|0,1,1]=4 1869 B14R2.2332 N#Cc1ccc2cc(ccc2n1)O 271570a_203496583355_200012353941 [0,2,0,0,0,0|1,0,1]=4 1870 B14R2.2332 N#Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100000091635 [0,2,0,0,0,0|0,0,2]=4 1871 B14R2.2332 O=Cc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356508 [0,2,0,0,0,0|1,0,0]=3 1872 B14R2.2332 O=Cc1ccc2cc(cnc2c1)O 271570a_203496583355_100010114372 [0,2,0,0,0,0|2,0,0]=4 1873 B14R2.2332 O=Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100000087602 [0,2,0,0,0,0|0,0,2]=4 1874 B14R2.2332 OCc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356509 [0,2,0,0,0,0|1,0,1]=4 1875 B14R2.2332 [13CH3]Nc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200025704644 [0,2,0,0,0,0|0,0,2]=4 1876 B14R2.2332 [13CH3]Nc1ccc2cc(ccc2c1)Br 34a_100000185457_200025704644 [0,2,0,0,0,0|2,0,0]=4 1877 B14R2.2332 [13CH3]Nc1ccc2cc(ccc2c1)Br 7a_100000185457_200025704644 [0,2,0,0,0,0|2,0,0]=4 1878 B14R2.2332 [13CH3]Nc1ccc2oc(=O)ccc2c1 7a_100000008519_200025704644 [0,2,0,0,0,0|1,0,0]=3 1879 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200025704644 [0,2,0,0,0,0|0,0,2]=4 1880 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 34a_100000185455_200025704644 [0,2,0,0,0,0|1,0,1]=4 1881 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 7a_100000185455_200025704644 [0,2,0,0,0,0|1,0,1]=4 1882 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_200025704644 [0,2,0,0,0,0|1,0,1]=4 1883 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_200025704644 [0,2,0,0,0,0|1,0,1]=4 1884 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 34a_100009847029_200025704644 [0,2,0,0,0,0|1,0,1]=4 1885 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 7a_100009847029_200025704644 [0,2,0,0,0,0|1,0,1]=4 1886 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 34a_100009849208_200025704644 [0,2,0,0,0,0|1,0,1]=4 1887 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 7a_100009849208_200025704644 [0,2,0,0,0,0|1,0,1]=4 1888 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 34a_100000066265_200025704644 [0,2,0,0,0,0|1,0,0]=3 1889 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 7a_100000066265_200025704644 [0,2,0,0,0,0|1,0,0]=3 1890 B14R2.2332 [13CH3]Sc1ccc2[nH]c(=O)ccc2c1 62a_200025704644_100011934725 [0,2,0,0,0,0|0,0,0]=2 1891 B14R2.2332 [13CH3]Sc1ccc2[nH]c(=O)cnc2c1 62a_200025704644_100010209493 [0,2,0,0,0,0|1,0,0]=3 1892 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200025704644 [0,2,0,0,0,0|0,0,2]=4 1893 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_200025704644_100000754843 [0,2,0,0,0,0|0,0,2]=4 1894 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)N2 62a_200025704644_100010171468 [0,2,0,0,0,0|1,0,1]=4 1895 B14R2.2332 [13CH3]Sc1ccc2c(c1)NCC(=O)N2 62a_200025704644_100000693460 [0,2,0,0,0,0|1,0,1]=4 1896 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)Br 62a_100012344972_200025704644 [0,2,0,0,0,0|1,1,0]=4 1897 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)Br 62a_200025704644_100012344972 [0,2,0,0,0,0|1,1,0]=4 1898 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)F 62a_100009817052_200025704644 [0,2,0,0,0,0|1,1,0]=4 1899 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)F 62a_200025704644_100009817052 [0,2,0,0,0,0|1,1,0]=4 1900 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)N 62a_100000185457_200025704644 [0,2,0,0,0,0|1,1,0]=4 1901 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)N 62a_200025704644_100000185457 [0,2,0,0,0,0|1,1,0]=4 1902 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2c1)O 62a_200025704644_100000185455 [0,2,0,0,0,0|1,0,1]=4 1903 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200012355665_200025704644 [0,2,0,0,0,0|0,1,1]=4 1904 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200025704644_100011998705 [0,2,0,0,0,0|0,1,1]=4 1905 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)O 62a_200025704644_100009849208 [0,2,0,0,0,0|0,1,1]=4 1906 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)Cl 62a_200025704644_200012034268 [0,2,0,0,0,0|1,0,1]=4 1907 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)N 62a_100011934619_200025704644 [0,2,0,0,0,0|1,0,1]=4 1908 B14R2.2332 [13CH3]Sc1ccc2oc(=O)ccc2c1 62a_200025704644_100009999946 [0,2,0,0,0,0|1,0,0]=3 1909 B14R2.2332 [13CH3]Sc1cnc2[nH]c(=O)cnc2c1 62a_200025704644_200010159638 [0,2,0,0,0,0|2,0,0]=4 1910 B14R2.8239 CC1Oc2ccc(cc2NC1=O)O 271570a_203496583355_100000745501 [0,2,0,0,0,0|1,0,1]=4 1911 B14R2.8239 CN1Cc2cc(ccc2NC1=O)O 271570a_203496583355_100000188780 [0,2,0,0,0,0|1,0,1]=4 1912 B14R2.8239 Cc1cc2cc(ccc2nc1N)O 271570a_203496583355_100011830096 [0,2,0,0,0,0|1,0,1]=4 1913 B14R2.8239 O=c1[nH]c2cc(cnc2[nH]c1=O)O 271570a_203496583355_100009812773 [0,2,0,0,0,0|2,0,0]=4 1914 B14R2.8239 O=c1[nH]c2ccc(cc2[nH]c1=O)O 271570a_203496583355_100011221361 [0,2,0,0,0,0|1,0,0]=3 1915 B14R2.8239 Oc1ccc2cc(c(cc2c1)O)O 271570a_203496583355_100010179872 [0,2,0,0,0,0|1,0,1]=4 1916 B14R2.8239 Oc1ccc2cc(c(nc2c1)Cl)Br 271570a_203496583355_100135414633 [0,2,0,0,0,0|1,0,1]=4 1917 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [0,2,0,0,0,0|1,0,1]=4 1918 B14R2.29365 Cc1cc(cc2c1OCC(=O)N2)O 271570a_203496583355_100012356449 [0,2,0,0,0,0|1,0,1]=4 1919 B14R2.29365 Cc1cc(nc2c1ccc(c2)N)O 271570a_203496583355_100000103534 [0,2,0,0,0,0|0,0,2]=4 1920 B14R2.29365 Nc1nc(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100010077259 [0,2,0,0,0,0|2,0,0]=4 1921 B14R2.29365 O=C1COc2c(cc(cc2N1)O)F 271570a_203496583355_100012356450 [0,2,0,0,0,0|1,0,1]=4 1922 B14R2.29365 O=c1[nH]c(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100012351534 [0,2,0,0,0,0|1,0,0]=3 1923 B14R2.29365 O=c1[nH]c(=O)c2ccc(nc2[nH]1)O 271570a_203496583355_100000117996 [0,2,0,0,0,0|2,0,0]=4 1924 B14R2.29365 O=c1[nH]c2cc(ccc2c(=O)o1)O 271570a_203496583355_100000723304 [0,2,0,0,0,0|1,0,0]=3 1925 B14R2.29365 O=c1cc(c2ccc(cc2o1)O)O 271570a_203496583355_100010062223 [0,2,0,0,0,0|1,0,0]=3 1926 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [0,2,0,0,0,0|1,0,1]=4 1927 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [0,2,0,0,0,0|1,0,1]=4 1928 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [0,2,0,0,0,0|1,0,1]=4 1929 B14R2.8045 Cc1cc(nc2c1cccc2C)O 271570a_203496583355_100000008058 [0,2,0,0,0,0|0,0,2]=4 1930 B14R2.8045 O=c1[nH]c(=O)c2cccc(c2[nH]1)O 271570a_203496583355_100012357391 [0,2,0,0,0,0|1,0,0]=3 1931 B14R2.8045 O=c1[nH]c(=O)c2ccnc(c2[nH]1)O 271570a_203496583355_209893295357 [0,2,0,0,0,0|2,0,0]=4 1932 B14R2.8045 O=c1[nH]c2c(cccc2c(=O)o1)O 271570a_203496583355_100000695655 [0,2,0,0,0,0|1,0,0]=3 1933 B14R2.8045 O=c1cc(c2cccc(c2[nH]1)O)O 271570a_203496583355_200010201894 [0,2,0,0,0,0|0,0,0]=2 1934 B14R2.8235 Cc1cc(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100009820897 [0,2,0,0,0,0|0,0,0]=2 1935 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011333642 [0,2,0,0,0,0|1,0,0]=3 1936 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O 271570a_203496583355_100000689691 [0,2,0,0,0,0|1,0,1]=4 1937 B14R2.8235 Cc1cc(c2cc(ccc2n1)O)N 271570a_203496583355_100000238323 [0,2,0,0,0,0|1,0,1]=4 1938 B14R2.8235 Cc1cc(c2nc(ccc2c1)O)C 271570a_203496583355_200012017542 [0,2,0,0,0,0|0,0,2]=4 1939 B14R2.8235 Cc1cc(nc2c1cc(cc2)F)O 271570a_203496583355_200000079853 [0,2,0,0,0,0|0,0,2]=4 1940 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [0,2,0,0,0,0|1,0,1]=4 1941 B14R2.8235 O=C1CCc2cc(cc(c2N1)O)O 271570a_203496583355_100021432387 [0,2,0,0,0,0|0,0,2]=4 1942 B14R2.8235 O=C1Cc2ccc(cc2C(=O)N1)O 271570a_203496583355_100010161110 [0,2,0,0,0,0|2,0,0]=4 1943 B14R2.8235 O=c1[nH]c(=O)c2cc(ccc2[nH]1)O 271570a_203496583355_100011934062 [0,2,0,0,0,0|1,0,0]=3 1944 B14R2.8235 O=c1[nH]c(=O)c2cc(ccc2o1)O 271570a_203496583355_200000725568 [0,2,0,0,0,0|2,0,0]=4 1945 B14R2.8235 O=c1[nH]c2ccc(cc2c(=O)o1)O 271570a_203496583355_100000216498 [0,2,0,0,0,0|1,0,0]=3 1946 B14R2.8235 O=c1cc(c2cc(ccc2[nH]1)O)O 271570a_203496583355_100000695641 [0,2,0,0,0,0|0,0,0]=2 1947 B14R2.8235 O=c1cc(c2cc(ccc2o1)O)O 271570a_203496583355_100009814091 [0,2,0,0,0,0|1,0,0]=3 1948 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)F)O 271570a_203496583355_100012034177 [0,2,0,0,0,0|0,0,0]=2 1949 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)Cl 271570a_203496583355_200014262637 [0,2,0,0,0,0|0,0,0]=2 1950 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)F 271570a_203496583355_200012639799 [0,2,0,0,0,0|0,0,0]=2 1951 B14R2.8235 Oc1cc(c2cc(ccc2c1)O)F 271570a_203496583355_100010201084 [0,2,0,0,0,0|1,0,1]=4 1952 B14R2.8751 Cc1ccc2c(ccc(c2n1)N)O 271570a_203496583355_100012970290 [0,2,0,0,0,0|1,0,1]=4 1953 B14R2.11684 C=Cc1cccc2c1[nH]c(=O)cc2 271570a_100011290941_100000688906 [0,2,0,0,0,0|0,0,0]=2 1954 B14R2.11684 C=Cc1cccc2c1cc(cc2)O 271570a_100011290941_100010169565 [0,2,0,0,0,0|1,0,1]=4 1955 B14R2.11684 C=Cc1cccc2c1nc(cc2)C 271570a_100011290941_100011934484 [0,2,0,0,0,0|1,0,1]=4 1956 B14R2.11684 C=Cc1cccc2c1nc(cc2)N 271570a_100011290941_100000687151 [0,2,0,0,0,0|1,0,1]=4 1957 B14R2.11684 CNc1cccc2c1NC(=O)CO2 2230a_100000070307_200000210301 [0,2,0,0,0,0|1,0,1]=4 1958 B14R2.11684 CNc1cccc2c1cc(cc2)Br 34a_100010090012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1959 B14R2.11684 CNc1cccc2c1cc(cc2)O 34a_100000034012_200000210301 [0,2,0,0,0,0|1,0,1]=4 1960 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [0,2,0,0,0,0|1,0,1]=4 1961 B14R2.11684 COc1cccc2c1NC(=O)CC2 34a_100000082220_200000210301 [0,2,0,0,0,0|0,0,2]=4 1962 B14R2.11684 COc1cccc2c1NC(=O)CO2 7a_100000098422_200000210301 [0,2,0,0,0,0|1,0,1]=4 1963 B14R2.11684 COc1cccc2c1cc(cc2)Br 34a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 1964 B14R2.11684 COc1cccc2c1cc(cc2)Br 7a_100010089991_200000210301 [0,2,0,0,0,0|2,0,0]=4 1965 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [0,2,0,0,0,0|2,0,0]=4 1966 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [0,2,0,0,0,0|2,0,0]=4 1967 B14R2.11684 COc1cccc2c1cc(cc2)Cl 34a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 1968 B14R2.11684 COc1cccc2c1cc(cc2)Cl 7a_100009840344_200000210301 [0,2,0,0,0,0|2,0,0]=4 1969 B14R2.11684 COc1cccc2c1cc(cc2)F 34a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 1970 B14R2.11684 COc1cccc2c1cc(cc2)F 7a_100009881884_200000210301 [0,2,0,0,0,0|2,0,0]=4 1971 B14R2.11684 COc1cccc2c1cc(cc2)N 34a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1972 B14R2.11684 COc1cccc2c1cc(cc2)N 7a_100132313934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1973 B14R2.11684 COc1cccc2c1nc(cc2)Br 34a_100010153751_200000210301 [0,2,0,0,0,0|1,0,1]=4 1974 B14R2.11684 COc1cccc2c1nc(cc2)Br 7a_100010153751_200000210301 [0,2,0,0,0,0|1,0,1]=4 1975 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [0,2,0,0,0,0|1,0,1]=4 1976 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [0,2,0,0,0,0|1,0,1]=4 1977 B14R2.11684 COc1cccc2c1nc(cc2)Cl 34a_100000013812_200000210301 [0,2,0,0,0,0|1,0,1]=4 1978 B14R2.11684 COc1cccc2c1nc(cc2)Cl 7a_100000013812_200000210301 [0,2,0,0,0,0|1,0,1]=4 1979 B14R2.11684 COc1cccc2c1nc(cc2)N 34a_100000032106_200000210301 [0,2,0,0,0,0|1,0,1]=4 1980 B14R2.11684 COc1cccc2c1nc(cc2)N 7a_100000032106_200000210301 [0,2,0,0,0,0|1,0,1]=4 1981 B14R2.11684 COc1cccc2c1nc(cc2)O 271570a_203496583355_200011787714 [0,2,0,0,0,0|0,0,2]=4 1982 B14R2.11684 CSc1cccc2c1[nH]c(=O)cc2 62a_200000210301_100000688906 [0,2,0,0,0,0|0,0,0]=2 1983 B14R2.11684 CSc1cccc2c1cc(cc2)O 62a_200000210301_100010169565 [0,2,0,0,0,0|1,0,1]=4 1984 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [0,2,0,0,0,0|1,0,1]=4 1985 B14R2.11684 CSc1cccc2c1nc(cc2)Cl 62a_200000210301_100012034269 [0,2,0,0,0,0|1,0,1]=4 1986 B14R2.11684 CSc1cccc2c1nc(cc2)N 62a_100000687151_200000210301 [0,2,0,0,0,0|1,0,1]=4 1987 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [0,2,0,0,0,0|2,0,0]=4 1988 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [0,2,0,0,0,0|2,0,0]=4 1989 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [0,2,0,0,0,0|1,0,1]=4 1990 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [0,2,0,0,0,0|1,0,1]=4 1991 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [0,2,0,0,0,0|1,0,1]=4 1992 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [0,2,0,0,0,0|1,0,1]=4 1993 B14R2.11684 [13CH3]Nc1cccc2c1NC(=O)CO2 2230a_100000070307_200025704644 [0,2,0,0,0,0|1,0,1]=4 1994 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)Br 34a_100010090012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1995 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)O 34a_100000034012_200025704644 [0,2,0,0,0,0|1,0,1]=4 1996 B14R2.11684 [13CH3]Oc1cccc2c1NC(=O)CC2 34a_100000082220_200025704644 [0,2,0,0,0,0|0,0,2]=4 1997 B14R2.11684 [13CH3]Oc1cccc2c1NC(=O)CO2 7a_100000098422_200025704644 [0,2,0,0,0,0|1,0,1]=4 1998 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 34a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 1999 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 7a_100010089991_200025704644 [0,2,0,0,0,0|2,0,0]=4 2000 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 34a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 2001 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 7a_100009840344_200025704644 [0,2,0,0,0,0|2,0,0]=4 2002 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 34a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 2003 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 7a_100009881884_200025704644 [0,2,0,0,0,0|2,0,0]=4 2004 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 34a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 2005 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 7a_100132313934_200025704644 [0,2,0,0,0,0|2,0,0]=4 2006 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 34a_100010153751_200025704644 [0,2,0,0,0,0|1,0,1]=4 2007 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 7a_100010153751_200025704644 [0,2,0,0,0,0|1,0,1]=4 2008 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 34a_100000013812_200025704644 [0,2,0,0,0,0|1,0,1]=4 2009 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 7a_100000013812_200025704644 [0,2,0,0,0,0|1,0,1]=4 2010 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 34a_100000032106_200025704644 [0,2,0,0,0,0|1,0,1]=4 2011 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 7a_100000032106_200025704644 [0,2,0,0,0,0|1,0,1]=4 2012 B14R2.11684 [13CH3]Sc1cccc2c1[nH]c(=O)cc2 62a_200025704644_100000688906 [0,2,0,0,0,0|0,0,0]=2 2013 B14R2.11684 [13CH3]Sc1cccc2c1cc(cc2)O 62a_200025704644_100010169565 [0,2,0,0,0,0|1,0,1]=4 2014 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)Cl 62a_200025704644_100012034269 [0,2,0,0,0,0|1,0,1]=4 2015 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)N 62a_100000687151_200025704644 [0,2,0,0,0,0|1,0,1]=4 2016 B14R2.28472 CN1Cc2c(cccc2NC1=O)O 271570a_203496583355_200010992586 [0,2,0,0,0,0|1,0,1]=4 2017 B14R2.28472 Oc1nc2c(cccc2cc1F)O 271570a_203496583355_100010140959 [0,2,0,0,0,0|0,0,2]=4 2018 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccc2 271570a_100011290941_100000075698 [0,2,0,0,0,0|0,0,0]=2 2019 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccn2 271570a_100011290941_100010499609 [0,2,0,0,0,0|1,0,0]=3 2020 B14R2.1146 C=Cc1cc(cc2c1cccc2)N 271570a_100011290941_100010089974 [0,2,0,0,0,0|2,0,0]=4 2021 B14R2.1146 C=Cc1cc(cc2c1cccc2)O 271570a_100011290941_100010001680 [0,2,0,0,0,0|1,0,1]=4 2022 B14R2.1146 C=Cc1cc(nc2c1cccc2)C 271570a_100011290941_100000764982 [0,2,0,0,0,0|1,0,1]=4 2023 B14R2.1146 CNc1cc(=O)[nH]c2c1cccc2 27a_100102657272_100000075698 [0,2,0,0,0,0|0,0,0]=2 2024 B14R2.1146 CNc1cc(=O)[nH]c2c1cccn2 27a_100102657272_100010499609 [0,2,0,0,0,0|1,0,0]=3 2025 B14R2.1146 CNc1cc(cc2c1cccc2)Br 34a_100010171453_200000210301 [0,2,0,0,0,0|2,0,0]=4 2026 B14R2.1146 CNc1cc(nc2c1cccc2)C 27a_100102657272_100000735862 [0,2,0,0,0,0|1,0,1]=4 2027 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 2028 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [0,2,0,0,0,0|2,0,0]=4 2029 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [0,2,0,0,0,0|1,0,1]=4 2030 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [0,2,0,0,0,0|0,0,2]=4 2031 B14R2.1146 CSc1cc(=O)[nH]c2c1cccc2 62a_200000210301_100000075698 [0,2,0,0,0,0|0,0,0]=2 2032 B14R2.1146 CSc1cc(=O)[nH]c2c1cccn2 62a_200000210301_100010499609 [0,2,0,0,0,0|1,0,0]=3 2033 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 2034 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_200000210301_100010089974 [0,2,0,0,0,0|2,0,0]=4 2035 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [0,2,0,0,0,0|1,0,1]=4 2036 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_100000764982_200000210301 [0,2,0,0,0,0|1,0,1]=4 2037 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_200000210301_100000735862 [0,2,0,0,0,0|1,0,1]=4 2038 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [0,2,0,0,0,0|1,0,1]=4 2039 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_100000764982_200025704644 [0,2,0,0,0,0|1,0,1]=4 2040 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_200025704644_100000735862 [0,2,0,0,0,0|1,0,1]=4 2041 B14R2.1146 [13CH3]Nc1cc(cc2c1cccc2)Br 34a_100010171453_200025704644 [0,2,0,0,0,0|2,0,0]=4 2042 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 2043 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [0,2,0,0,0,0|2,0,0]=4 2044 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccc2 62a_200025704644_100000075698 [0,2,0,0,0,0|0,0,0]=2 2045 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccn2 62a_200025704644_100010499609 [0,2,0,0,0,0|1,0,0]=3 2046 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 2047 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_200025704644_100010089974 [0,2,0,0,0,0|2,0,0]=4 2048 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [0,2,0,0,0,0|1,0,1]=4 2049 B14R2.28480 O=c1[nH]c2cccc(c2c(=O)o1)O 271570a_203496583355_100010201677 [0,2,0,0,0,0|1,0,0]=3 2050 B14R2.1073 C=Cc1cccc2c1CCC(=O)N2 271570a_100011290941_100010232564 [0,2,0,0,0,0|0,0,2]=4 2051 B14R2.1073 C=Cc1cccc2c1OCC(=O)N2 271570a_100011290941_100012355675 [0,2,0,0,0,0|1,0,1]=4 2052 B14R2.1073 C=Cc1cccc2c1ccc(=O)[nH]2 271570a_100011290941_100000726145 [0,2,0,0,0,0|0,0,0]=2 2053 B14R2.1073 C=Cc1cccc2c1ccc(n2)C 271570a_100011290941_100010173736 [0,2,0,0,0,0|1,0,1]=4 2054 B14R2.1073 C=Cc1cccc2c1ccc(n2)N 271570a_100011290941_100000723655 [0,2,0,0,0,0|1,0,1]=4 2055 B14R2.1073 CNc1cccc2c1ccc(c2)Br 34a_100010090037_200000210301 [0,2,0,0,0,0|2,0,0]=4 2056 B14R2.1073 CNc1cccc2c1ccc(c2)O 34a_100000034668_200000210301 [0,2,0,0,0,0|1,0,1]=4 2057 B14R2.1073 CNc1cccc2c1ccc(n2)C 27a_100102657272_100010173736 [0,2,0,0,0,0|1,0,1]=4 2058 B14R2.1073 CNc1cccc2c1ccc(n2)C 34a_106741707140_200000210301 [0,2,0,0,0,0|1,0,1]=4 2059 B14R2.1073 COc1cccc2c1CCC(=O)N2 34a_100000066681_200000210301 [0,2,0,0,0,0|0,0,2]=4 2060 B14R2.1073 COc1cccc2c1CCC(=O)N2 7a_100000066681_200000210301 [0,2,0,0,0,0|0,0,2]=4 2061 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 2062 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [0,2,0,0,0,0|2,0,0]=4 2063 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 2064 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [0,2,0,0,0,0|2,0,0]=4 2065 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [0,2,0,0,0,0|2,0,0]=4 2066 B14R2.1073 COc1cccc2c1ccc(n2)O 271570a_203496583355_100010382897 [0,2,0,0,0,0|0,0,2]=4 2067 B14R2.1073 CSc1cccc2c1CCC(=O)N2 62a_100010232564_200000210301 [0,2,0,0,0,0|0,0,2]=4 2068 B14R2.1073 CSc1cccc2c1CCC(=O)N2 62a_200000210301_100010232564 [0,2,0,0,0,0|0,0,2]=4 2069 B14R2.1073 CSc1cccc2c1ccc(=O)[nH]2 62a_200000210301_100000726145 [0,2,0,0,0,0|0,0,0]=2 2070 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_100010173736_200000210301 [0,2,0,0,0,0|1,0,1]=4 2071 B14R2.1073 CSc1cccc2c1ccc(n2)C 62a_200000210301_100010173736 [0,2,0,0,0,0|1,0,1]=4 2072 B14R2.1073 CSc1cccc2c1ccc(n2)N 62a_100000723655_200000210301 [0,2,0,0,0,0|1,0,1]=4 2073 B14R2.1073 Cc1ccc2c(cccc2n1)N[13CH3] 34a_106741707140_200025704644 [0,2,0,0,0,0|1,0,1]=4 2074 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_100010173736_200025704644 [0,2,0,0,0,0|1,0,1]=4 2075 B14R2.1073 Cc1ccc2c(cccc2n1)S[13CH3] 62a_200025704644_100010173736 [0,2,0,0,0,0|1,0,1]=4 2076 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)Br 34a_100010090037_200025704644 [0,2,0,0,0,0|2,0,0]=4 2077 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)O 34a_100000034668_200025704644 [0,2,0,0,0,0|1,0,1]=4 2078 B14R2.1073 [13CH3]Oc1cccc2c1CCC(=O)N2 34a_100000066681_200025704644 [0,2,0,0,0,0|0,0,2]=4 2079 B14R2.1073 [13CH3]Oc1cccc2c1CCC(=O)N2 7a_100000066681_200025704644 [0,2,0,0,0,0|0,0,2]=4 2080 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 2081 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [0,2,0,0,0,0|2,0,0]=4 2082 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 2083 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [0,2,0,0,0,0|2,0,0]=4 2084 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [0,2,0,0,0,0|2,0,0]=4 2085 B14R2.1073 [13CH3]Sc1cccc2c1CCC(=O)N2 62a_100010232564_200025704644 [0,2,0,0,0,0|0,0,2]=4 2086 B14R2.1073 [13CH3]Sc1cccc2c1CCC(=O)N2 62a_200025704644_100010232564 [0,2,0,0,0,0|0,0,2]=4 2087 B14R2.1073 [13CH3]Sc1cccc2c1ccc(=O)[nH]2 62a_200025704644_100000726145 [0,2,0,0,0,0|0,0,0]=2 2088 B14R2.1073 [13CH3]Sc1cccc2c1ccc(n2)N 62a_100000723655_200025704644 [0,2,0,0,0,0|1,0,1]=4 2089 B10R0.91 C=CC=CC(=O)NCCC=C 1626a_100015191253_100016291481 [0,0,2,0,0,0|0,0,2]=4 2090 B10R0.91 C=CC=CC(=O)NNCC=C 22a_100020588587_100016291481 [0,0,2,0,0,0|1,0,1]=4 2091 B10R0.91 C=CCNC(=O)C=C/C=C/C 1626a_100020586998_100000185730 [0,0,2,0,0,0|0,0,2]=4 2092 B10R0.91 C=CCNC(=O)C=C/C=C/C 240690a_100020586998_100000185730 [0,0,2,0,0,0|0,0,2]=4 2093 B12R2.315 C=Cc1cccc2c1CC=C2 271570a_100011290941_100009844718 [0,0,1,1,0,0|2,0,0]=4 2094 B12R2.315 C=Cc1cccc2c1NCC2 271570a_100011290941_100016995435 [0,0,1,1,0,0|1,0,1]=4 2095 B12R2.315 C=Cc1cccc2c1[nH]cc2 271570a_100011290941_100009813418 [0,0,1,1,0,0|1,0,0]=3 2096 B12R2.315 C=Cc1cccc2c1[nH]nc2 271570a_100011290941_100009816125 [0,0,1,1,0,0|2,0,0]=4 2097 B12R2.315 C=Cc1cccc2c1[nH]nn2 271570a_100011290941_100009820029 [0,0,1,1,0,0|2,0,0]=4 2098 B12R2.315 C=Cc1cccc2c1cc[nH]2 271570a_100011290941_100000685724 [0,0,1,1,0,0|2,0,0]=4 2099 B12R2.315 C=Cc1cccc2c1cco2 271570a_100011290941_100000756496 [0,0,1,1,0,0|1,0,1]=4 2100 B12R2.315 C=Cc1cccc2c1ccs2 271570a_100011290941_100009816950 [0,0,1,1,0,0|1,1,0]=4 2101 B12R2.315 C=Cc1cccc2c1nc[nH]2 271570a_100011290941_100011935113 [0,0,1,1,0,0|1,0,1]=4 2102 B12R2.315 C=Cc1cccc2c1nco2 271570a_100011290941_100009816834 [0,0,1,1,0,0|0,0,2]=4 2103 B12R2.315 C=Cc1cccc2c1ncs2 271570a_100011290941_100000726125 [0,0,1,1,0,0|0,1,1]=4 2104 B12R2.315 C=Cc1cccc2c1occ2 271570a_100011290941_100011935138 [0,0,1,1,0,0|2,0,0]=4 2105 B12R2.315 C=Cc1cccc2c1ocn2 271570a_100011290941_100000728214 [0,0,1,1,0,0|2,0,0]=4 2106 B12R2.315 C=Cc1cccc2c1scc2 271570a_100011290941_100000766737 [0,0,1,1,0,0|2,0,0]=4 2107 B12R2.315 C=Cc1cccc2c1scn2 271570a_100011290941_100010246326 [0,0,1,1,0,0|2,0,0]=4 2108 B12R2.315 C=Cc1ccnc2c1[nH]cc2 271570a_100011290941_100009863063 [0,0,1,1,0,0|2,0,0]=4 2109 B12R2.315 C=Cc1cncc2c1[nH]cc2 271570a_100011290941_100000217057 [0,0,1,1,0,0|2,0,0]=4 2110 B12R2.315 C=Cc1cncc2c1[nH]cn2 271570a_100011290941_100000759552 [0,0,1,1,0,0|2,0,0]=4 2111 B12R2.315 C=Cc1nccc2c1[nH]cc2 271570a_100011290941_100009816714 [0,0,1,1,0,0|2,0,0]=4 2112 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [0,0,1,0,1,0|0,0,2]=4 2113 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [0,0,1,0,1,0|1,0,1]=4 2114 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [0,0,1,0,1,0|1,0,1]=4 2115 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [0,0,1,0,1,0|1,0,1]=4 2116 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [0,0,1,0,1,0|1,0,1]=4 2117 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [0,0,1,0,1,0|1,0,1]=4 2118 B10R1.27 C=CC(=O)Cc1ccsc1 1458a_100000185746_100011233845 [0,0,1,0,1,0|2,0,0]=4 2119 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [0,0,1,0,1,0|2,0,0]=4 2120 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,0,1,0,1,0|1,0,1]=4 2121 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [0,0,1,0,1,0|2,0,0]=4 2122 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [0,0,1,0,1,0|2,0,0]=4 2123 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [0,0,1,0,1,0|2,0,0]=4 2124 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [0,0,1,0,1,0|2,0,0]=4 2125 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [0,0,1,0,1,0|1,0,1]=4 2126 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [0,0,1,0,1,0|0,0,2]=4 2127 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [0,0,1,0,1,0|1,0,1]=4 2128 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [0,0,1,0,1,0|1,0,1]=4 2129 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [0,0,1,0,1,0|1,0,1]=4 2130 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [0,0,1,0,1,0|1,0,1]=4 2131 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [0,0,1,0,1,0|1,0,1]=4 2132 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [0,0,1,0,1,0|1,0,1]=4 2133 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [0,0,1,0,1,0|0,0,2]=4 2134 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [0,0,1,0,1,0|2,0,0]=4 2135 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [0,0,1,0,1,0|1,0,1]=4 2136 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [0,0,1,0,1,0|1,0,1]=4 2137 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [0,0,1,0,1,0|1,0,1]=4 2138 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [0,0,1,0,1,0|1,0,1]=4 2139 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [0,0,1,0,1,0|1,0,1]=4 2140 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [0,0,1,0,1,0|1,0,1]=4 2141 B10R1.66 CC(=O)C=Cc1cccs1 1458a_100000182767_200000210301 [0,0,1,0,1,0|2,0,0]=4 2142 B10R1.66 CC(=O)C=Cc1ccoc1 1458a_100000238621_200000210301 [0,0,1,0,1,0|2,0,0]=4 2143 B10R1.66 CC(=O)C=Cc1ccsc1 1458a_100000698588_200000210301 [0,0,1,0,1,0|2,0,0]=4 2144 B10R1.66 [13CH3]C(=O)C=Cc1cccs1 1458a_100000182767_200025704644 [0,0,1,0,1,0|2,0,0]=4 2145 B10R1.66 [13CH3]C(=O)C=Cc1ccoc1 1458a_100000238621_200025704644 [0,0,1,0,1,0|2,0,0]=4 2146 B10R1.66 [13CH3]C(=O)C=Cc1ccsc1 1458a_100000698588_200025704644 [0,0,1,0,1,0|2,0,0]=4 2147 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [0,0,1,0,0,1|1,0,0]=3 2148 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [0,0,1,0,0,1|1,0,0]=3 2149 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [0,0,1,0,0,1|1,0,0]=3 2150 B12R1.252 CC(=O)NN=Cc1ccccc1 4a_100000189765_100015611070 [0,0,1,0,0,1|2,0,0]=4 2151 B12R1.252 NC(=O)CCNc1ccccc1 34a_100000106764_100000731001 [0,0,1,0,0,1|0,0,2]=4 2152 B12R1.252 NC(=O)CCOc1ccccc1 34a_100000210340_100000731001 [0,0,1,0,0,1|0,0,2]=4 2153 B12R1.252 NC(=O)CCOc1ccccc1 7a_100000210340_100000744528 [0,0,1,0,0,1|0,0,2]=4 2154 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000719477_100000744528 [0,0,1,0,0,1|0,0,2]=4 2155 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000744528_100000041952 [0,0,1,0,0,1|0,0,2]=4 2156 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100000711301_100015291786 [0,0,1,0,0,1|0,0,2]=4 2157 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100015324214_100000747473 [0,0,1,0,0,1|0,0,2]=4 2158 B12R1.252 NC(=O)CNCc1ccccc1 34a_100015324214_100000187820 [0,0,1,0,0,1|0,0,2]=4 2159 B12R1.252 NC(=O)COCc1ccccc1 34a_100000210790_100000187820 [0,0,1,0,0,1|0,0,2]=4 2160 B12R1.252 NC(=O)COCc1ccccc1 7a_100000210790_100000187820 [0,0,1,0,0,1|0,0,2]=4 2161 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000211182_100000747473 [0,0,1,0,0,1|0,0,2]=4 2162 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000747473_100015291786 [0,0,1,0,0,1|0,0,2]=4 2163 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [0,0,1,0,0,1|1,0,0]=3 2164 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [0,0,1,0,0,1|1,0,0]=3