0 B14R2.781 C=C(C)c1cc2ccccc2cn1 271570a_100000694244_100000047361 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.781 C=C(C)c1ccc2ccccc2c1 271570a_100000694244_100000233703 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.781 C=C(C)c1ccc2ccccc2n1 271570a_100000694244_100011291633 [0,0,0,0,0,0|2,0,0]=2 3 B14R2.781 C=C(C)c1ccc2cccnc2c1 271570a_100000694244_100009816655 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.781 C=C(C)c1ccc2cccnc2n1 271570a_100000694244_100009888989 [0,0,0,0,0,0|3,0,0]=3 5 B14R2.781 C=C(C)c1ccc2ccncc2c1 271570a_100000694244_100000686496 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.781 C=C(C)c1ccc2ccncc2n1 271570a_100000694244_100000020162 [0,0,0,0,0,0|3,0,0]=3 7 B14R2.781 C=C(C)c1ccc2cnccc2c1 271570a_100000694244_100009816743 [0,0,0,0,0,0|4,0,0]=4 8 B14R2.781 C=C(C)c1ccc2ncccc2c1 271570a_100000694244_100000754243 [0,0,0,0,0,0|4,0,0]=4 9 B14R2.781 C=C(C)c1ccc2ncccc2n1 271570a_100000694244_100000073381 [0,0,0,0,0,0|3,0,0]=3 10 B14R2.781 C=C(C)c1ccc2nccnc2n1 271570a_100000694244_100012351543 [0,0,0,0,0,0|4,0,0]=4 11 B14R2.781 C=C(C)c1cnc2ccccc2c1 271570a_100000694244_100000737414 [0,0,0,0,0,0|4,0,0]=4 12 B14R2.781 C=C(C)c1cnc2ccccc2n1 271570a_100000694244_100000756483 [0,0,0,0,0,0|3,0,0]=3 13 B14R2.781 C=C(C)c1cnc2ncccc2n1 271570a_100000694244_100000084304 [0,0,0,0,0,0|4,0,0]=4 14 B14R2.781 C=C(C)c1ncc2ccccc2n1 271570a_100000694244_100000097389 [0,0,0,0,0,0|3,0,0]=3 15 B14R2.781 CC(=O)C1=Cc2ccccc2OC1 1458a_100000018039_200000210301 [0,0,0,0,0,0|3,0,1]=4 16 B14R2.781 CC(=O)c1ccc2ccccc2c1 1458a_100000210637_200000210301 [0,0,0,0,0,0|2,0,0]=2 17 B14R2.781 CC(=O)c1ccc2cccnc2c1 1458a_100011933907_200000210301 [0,0,0,0,0,0|3,0,0]=3 18 B14R2.781 CC(=O)c1ccc2ccncc2c1 1458a_100000070124_200000210301 [0,0,0,0,0,0|3,0,0]=3 19 B14R2.781 CC(=O)c1ccc2cnccc2c1 1458a_100011935275_200000210301 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.781 CC(=O)c1ccc2ncccc2c1 1458a_100011216044_200000210301 [0,0,0,0,0,0|3,0,0]=3 21 B14R2.781 CC(=O)c1ccc2nccnc2c1 1458a_100000184533_200000210301 [0,0,0,0,0,0|4,0,0]=4 22 B14R2.781 CN(C)c1ccc2ccccc2c1 2230a_100000181211_200000210301 [0,0,0,0,0,0|4,0,0]=4 23 B14R2.781 CN(C)c1ccc2ccccc2c1 269982a_100000181211_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B14R2.781 CN(C)c1ccc2ccccc2c1 34a_100000181211_200000210301 [0,0,0,0,0,0|4,0,0]=4 25 B14R2.781 CN(C)c1ccc2ccccc2n1 27a_100102631434_100011291633 [0,0,0,0,0,0|3,0,0]=3 26 B14R2.781 CN(C)c1ccc2cccnc2n1 27a_100102631434_100000075685 [0,0,0,0,0,0|4,0,0]=4 27 B14R2.781 CN(C)c1ccc2ccncc2n1 27a_100102631434_100000020162 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.781 CN(C)c1ccc2ncccc2n1 27a_100102631434_100000073381 [0,0,0,0,0,0|4,0,0]=4 29 B14R2.781 CN(C)c1cnc2ccccc2n1 27a_100102631434_100000756483 [0,0,0,0,0,0|4,0,0]=4 30 B14R2.781 CN(C)c1ncc2ccccc2n1 27a_100102631434_100000097389 [0,0,0,0,0,0|4,0,0]=4 31 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 2230a_100000181211_200025704644 [0,0,0,0,0,0|4,0,0]=4 32 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 269982a_100000181211_200025704644 [0,0,0,0,0,0|4,0,0]=4 33 B14R2.781 CN([13CH3])c1ccc2ccccc2c1 34a_100000181211_200025704644 [0,0,0,0,0,0|4,0,0]=4 34 B14R2.781 [13CH3]C(=O)C1=Cc2ccccc2OC1 1458a_100000018039_200025704644 [0,0,0,0,0,0|3,0,1]=4 35 B14R2.781 [13CH3]C(=O)c1ccc2ccccc2c1 1458a_100000210637_200025704644 [0,0,0,0,0,0|2,0,0]=2 36 B14R2.781 [13CH3]C(=O)c1ccc2cccnc2c1 1458a_100011933907_200025704644 [0,0,0,0,0,0|3,0,0]=3 37 B14R2.781 [13CH3]C(=O)c1ccc2ccncc2c1 1458a_100000070124_200025704644 [0,0,0,0,0,0|3,0,0]=3 38 B14R2.781 [13CH3]C(=O)c1ccc2cnccc2c1 1458a_100011935275_200025704644 [0,0,0,0,0,0|3,0,0]=3 39 B14R2.781 [13CH3]C(=O)c1ccc2ncccc2c1 1458a_100011216044_200025704644 [0,0,0,0,0,0|3,0,0]=3 40 B14R2.781 [13CH3]C(=O)c1ccc2nccnc2c1 1458a_100000184533_200025704644 [0,0,0,0,0,0|4,0,0]=4 41 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [1,0,0,0,0,0|3,0,0]=4 42 B13R2.57 C=Cc1ccc2ccccc2c1 271570a_100011290941_100000233703 [1,0,0,0,0,0|2,0,0]=3 43 B13R2.57 C=Cc1ccc2ccccc2n1 271570a_100011290941_100011291633 [1,0,0,0,0,0|1,0,0]=2 44 B13R2.57 C=Cc1ccc2cccnc2c1 271570a_100011290941_100009816655 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.57 C=Cc1ccc2cccnc2n1 271570a_100011290941_100009888989 [1,0,0,0,0,0|2,0,0]=3 46 B13R2.57 C=Cc1ccc2ccncc2c1 271570a_100011290941_100000686496 [1,0,0,0,0,0|3,0,0]=4 47 B13R2.57 C=Cc1ccc2ccncc2n1 271570a_100011290941_100000020162 [1,0,0,0,0,0|2,0,0]=3 48 B13R2.57 C=Cc1ccc2cnccc2c1 271570a_100011290941_100009816743 [1,0,0,0,0,0|3,0,0]=4 49 B13R2.57 C=Cc1ccc2ncccc2c1 271570a_100011290941_100000754243 [1,0,0,0,0,0|3,0,0]=4 50 B13R2.57 C=Cc1ccc2ncccc2n1 271570a_100011290941_100000073381 [1,0,0,0,0,0|2,0,0]=3 51 B13R2.57 C=Cc1ccc2nccnc2n1 271570a_100011290941_100012351543 [1,0,0,0,0,0|3,0,0]=4 52 B13R2.57 C=Cc1cnc2ccccc2c1 271570a_100011290941_100000737414 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.57 C=Cc1cnc2ccccc2n1 271570a_100011290941_100000756483 [1,0,0,0,0,0|2,0,0]=3 54 B13R2.57 C=Cc1cnc2ncccc2n1 271570a_100011290941_100000084304 [1,0,0,0,0,0|3,0,0]=4 55 B13R2.57 C=Cc1ncc2ccccc2n1 271570a_100011290941_100000097389 [1,0,0,0,0,0|2,0,0]=3 56 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [1,0,0,0,0,0|3,0,0]=4 57 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [1,0,0,0,0,0|3,0,0]=4 58 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [1,0,0,0,0,0|2,0,0]=3 59 B13R2.57 CNc1ccc2cccnc2n1 27a_100102657272_100000075685 [1,0,0,0,0,0|3,0,0]=4 60 B13R2.57 CNc1ccc2ccncc2n1 27a_100102657272_100000020162 [1,0,0,0,0,0|3,0,0]=4 61 B13R2.57 CNc1ccc2ncccc2n1 27a_100102657272_100000073381 [1,0,0,0,0,0|3,0,0]=4 62 B13R2.57 CNc1cnc2ccccc2n1 27a_100102657272_100000756483 [1,0,0,0,0,0|3,0,0]=4 63 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [1,0,0,0,0,0|3,0,0]=4 64 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [1,0,0,0,0,0|3,0,0]=4 65 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [1,0,0,0,0,0|3,0,0]=4 66 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [1,0,0,0,0,0|3,0,0]=4 67 B13R2.57 CSc1ccc2ccccc2n1 62a_100011291633_200000210301 [1,0,0,0,0,0|2,0,0]=3 68 B13R2.57 CSc1ccc2ccccc2n1 62a_200000210301_100011291633 [1,0,0,0,0,0|2,0,0]=3 69 B13R2.57 CSc1ccc2cccnc2n1 62a_100000075685_200000210301 [1,0,0,0,0,0|3,0,0]=4 70 B13R2.57 CSc1ccc2cccnc2n1 62a_200000210301_100000075685 [1,0,0,0,0,0|3,0,0]=4 71 B13R2.57 CSc1ccc2ccncc2n1 62a_200000210301_100000020162 [1,0,0,0,0,0|3,0,0]=4 72 B13R2.57 CSc1ccc2ncccc2n1 62a_200000210301_100000073381 [1,0,0,0,0,0|3,0,0]=4 73 B13R2.57 CSc1cnc2ccccc2n1 62a_100000756483_200000210301 [1,0,0,0,0,0|3,0,0]=4 74 B13R2.57 CSc1cnc2ccccc2n1 62a_200000210301_100000756483 [1,0,0,0,0,0|3,0,0]=4 75 B13R2.57 CSc1ncc2ccccc2n1 62a_200000210301_100000097389 [1,0,0,0,0,0|3,0,0]=4 76 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [1,0,0,0,0,0|3,0,0]=4 77 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [1,0,0,0,0,0|3,0,0]=4 78 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [1,0,0,0,0,0|3,0,0]=4 79 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [1,0,0,0,0,0|3,0,0]=4 80 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [1,0,0,0,0,0|3,0,0]=4 81 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_100011291633_200025704644 [1,0,0,0,0,0|2,0,0]=3 82 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_200025704644_100011291633 [1,0,0,0,0,0|2,0,0]=3 83 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_100000075685_200025704644 [1,0,0,0,0,0|3,0,0]=4 84 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_200025704644_100000075685 [1,0,0,0,0,0|3,0,0]=4 85 B13R2.57 [13CH3]Sc1ccc2ccncc2n1 62a_200025704644_100000020162 [1,0,0,0,0,0|3,0,0]=4 86 B13R2.57 [13CH3]Sc1ccc2ncccc2n1 62a_200025704644_100000073381 [1,0,0,0,0,0|3,0,0]=4 87 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_100000756483_200025704644 [1,0,0,0,0,0|3,0,0]=4 88 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_200025704644_100000756483 [1,0,0,0,0,0|3,0,0]=4 89 B13R2.57 [13CH3]Sc1ncc2ccccc2n1 62a_200025704644_100000097389 [1,0,0,0,0,0|3,0,0]=4 90 B15R2.627 C=C(C)c1ccc2ccccc2c1Br 271570a_100000694244_200010089984 [0,1,0,0,0,0|3,0,0]=4 91 B15R2.627 C=C(C)c1ccc2ccccc2c1C 271570a_100000694244_100010221197 [0,1,0,0,0,0|3,0,0]=4 92 B15R2.627 C=C(C)c1ccc2ccccc2c1F 271570a_100000694244_100009832041 [0,1,0,0,0,0|3,0,0]=4 93 B15R2.627 C=C(C)c1ccc2ccccc2c1N 271570a_100000694244_100009817101 [0,1,0,0,0,0|3,0,0]=4 94 B15R2.627 C=C(C)c1ccc2ccccc2c1O 271570a_100000694244_100009996032 [0,1,0,0,0,0|3,0,0]=4 95 B15R2.627 CC(=O)c1ccc2ccccc2c1Br 1458a_100000239384_200000210301 [0,1,0,0,0,0|2,0,0]=3 96 B15R2.627 CC(=O)c1ccc2ccccc2c1O 1458a_100000181341_200000210301 [0,1,0,0,0,0|2,0,0]=3 97 B15R2.627 CC(=O)c1ccc2cccnc2c1O 1458a_100000036822_200000210301 [0,1,0,0,0,0|3,0,0]=4 98 B15R2.627 NC(=O)c1ccc2ccccc2c1O 271570a_203496583355_100011091912 [0,1,0,0,0,0|2,0,0]=3 99 B15R2.627 [13CH3]C(=O)c1ccc2ccccc2c1Br 1458a_100000239384_200025704644 [0,1,0,0,0,0|2,0,0]=3 100 B15R2.627 [13CH3]C(=O)c1ccc2ccccc2c1O 1458a_100000181341_200025704644 [0,1,0,0,0,0|2,0,0]=3 101 B15R2.627 [13CH3]C(=O)c1ccc2cccnc2c1O 1458a_100000036822_200025704644 [0,1,0,0,0,0|3,0,0]=4 102 B15R2.984 C=C(C)c1cc2ccccc2cc1Br 271570a_100000694244_200010169544 [0,1,0,0,0,0|3,0,0]=4 103 B15R2.984 C=C(C)c1cc2ccccc2cc1Cl 271570a_100000694244_100010152806 [0,1,0,0,0,0|3,0,0]=4 104 B15R2.984 C=C(C)c1cc2ccccc2cc1N 271570a_100000694244_100009991566 [0,1,0,0,0,0|3,0,0]=4 105 B15R2.984 C=C(C)c1cc2ccccc2cc1O 271570a_100000694244_100009817189 [0,1,0,0,0,0|3,0,0]=4 106 B15R2.984 C=C(C)c1nc2ccccc2cc1Br 271570a_100000694244_100010072790 [0,1,0,0,0,0|2,0,0]=3 107 B15R2.984 C=C(C)c1nc2ccccc2cc1C 271570a_100000694244_100000751756 [0,1,0,0,0,0|2,0,0]=3 108 B15R2.984 C=C(C)c1nc2ccccc2cc1O 271570a_100000694244_200000100762 [0,1,0,0,0,0|2,0,0]=3 109 B15R2.984 C=C(C)c1nc2ccccc2nc1C 271570a_100000694244_100000185947 [0,1,0,0,0,0|3,0,0]=4 110 B15R2.984 C=C(C)c1nc2ccccc2nc1N 271570a_100000694244_100000009970 [0,1,0,0,0,0|3,0,0]=4 111 B15R2.984 C=C(C)c1nc2ncccc2cc1C 271570a_100000694244_100009877248 [0,1,0,0,0,0|3,0,0]=4 112 B15R2.984 CC(=O)c1cc2ccccc2cc1Cl 1458a_100010003416_200000210301 [0,1,0,0,0,0|2,0,0]=3 113 B15R2.984 CC(=O)c1cc2ccccc2cc1O 1458a_100000212107_200000210301 [0,1,0,0,0,0|2,0,0]=3 114 B15R2.984 Cc1cc2ccccc2nc1N(C)C 27a_100102631434_100000751756 [0,1,0,0,0,0|3,0,0]=4 115 B15R2.984 OB(O)c1cc2ccccc2cc1O 271570a_203496583355_200010152629 [0,1,0,0,0,0|2,0,1]=4 116 B15R2.984 [13CH3]C(=O)c1cc2ccccc2cc1Cl 1458a_100010003416_200025704644 [0,1,0,0,0,0|2,0,0]=3 117 B15R2.984 [13CH3]C(=O)c1cc2ccccc2cc1O 1458a_100000212107_200025704644 [0,1,0,0,0,0|2,0,0]=3 118 B15R2.1601 CC(O[13CH3])c1ccc2ccccc2c1 34a_100011215343_200025704644 [0,1,0,0,0,0|2,0,1]=4 119 B15R2.1601 CC(O[13CH3])c1ccc2ccccc2c1 7a_100011215343_200025704644 [0,1,0,0,0,0|2,0,1]=4 120 B15R2.1601 CCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100000210202 [0,1,0,0,0,0|2,0,0]=3 121 B15R2.1601 CCC(=O)c1ccc2cccnc2c1 1458a_100011933907_100000210202 [0,1,0,0,0,0|3,0,0]=4 122 B15R2.1601 CCC(=O)c1ccc2ccncc2c1 1458a_100000070124_100000210202 [0,1,0,0,0,0|3,0,0]=4 123 B15R2.1601 CCC(=O)c1ccc2cnccc2c1 1458a_100011935275_100000210202 [0,1,0,0,0,0|3,0,0]=4 124 B15R2.1601 CCC(=O)c1ccc2ncccc2c1 1458a_100011216044_100000210202 [0,1,0,0,0,0|3,0,0]=4 125 B15R2.1601 CNC(=O)c1ccc2ccccc2c1 11a_106832991635_100000210637 [0,1,0,0,0,0|2,0,0]=3 126 B15R2.1601 CNC(=O)c1ccc2ccccc2c1 1626a_100102657272_100000210637 [0,1,0,0,0,0|2,0,0]=3 127 B15R2.1601 CNC(=O)c1ccc2ccccc2c1 240690a_100102657272_100000210637 [0,1,0,0,0,0|2,0,0]=3 128 B15R2.1601 CNC(=O)c1ccc2ccccc2c1 527a_100102657272_100000210637 [0,1,0,0,0,0|2,0,0]=3 129 B15R2.1601 CNC(=O)c1ccc2cccnc2c1 11a_106832991635_100011933907 [0,1,0,0,0,0|3,0,0]=4 130 B15R2.1601 CNC(=O)c1ccc2cccnc2c1 1626a_100102657272_100011933907 [0,1,0,0,0,0|3,0,0]=4 131 B15R2.1601 CNC(=O)c1ccc2cccnc2c1 240690a_100102657272_100011933907 [0,1,0,0,0,0|3,0,0]=4 132 B15R2.1601 CNC(=O)c1ccc2cccnc2c1 527a_100102657272_100011933907 [0,1,0,0,0,0|3,0,0]=4 133 B15R2.1601 CNC(=O)c1ccc2ccncc2c1 11a_106832991635_100000070124 [0,1,0,0,0,0|3,0,0]=4 134 B15R2.1601 CNC(=O)c1ccc2ccncc2c1 1626a_100102657272_100000070124 [0,1,0,0,0,0|3,0,0]=4 135 B15R2.1601 CNC(=O)c1ccc2ccncc2c1 240690a_100102657272_100000070124 [0,1,0,0,0,0|3,0,0]=4 136 B15R2.1601 CNC(=O)c1ccc2ccncc2c1 527a_100102657272_100000070124 [0,1,0,0,0,0|3,0,0]=4 137 B15R2.1601 CNC(=O)c1ccc2cnccc2c1 11a_106832991635_100011935275 [0,1,0,0,0,0|3,0,0]=4 138 B15R2.1601 CNC(=O)c1ccc2cnccc2c1 1626a_100102657272_100011935275 [0,1,0,0,0,0|3,0,0]=4 139 B15R2.1601 CNC(=O)c1ccc2cnccc2c1 240690a_100102657272_100011935275 [0,1,0,0,0,0|3,0,0]=4 140 B15R2.1601 CNC(=O)c1ccc2cnccc2c1 527a_100102657272_100011935275 [0,1,0,0,0,0|3,0,0]=4 141 B15R2.1601 CNC(=O)c1ccc2ncccc2c1 11a_106832991635_100011216044 [0,1,0,0,0,0|3,0,0]=4 142 B15R2.1601 CNC(=O)c1ccc2ncccc2c1 1626a_100102657272_100011216044 [0,1,0,0,0,0|3,0,0]=4 143 B15R2.1601 CNC(=O)c1ccc2ncccc2c1 240690a_100102657272_100011216044 [0,1,0,0,0,0|3,0,0]=4 144 B15R2.1601 CNC(=O)c1ccc2ncccc2c1 527a_100102657272_100011216044 [0,1,0,0,0,0|3,0,0]=4 145 B15R2.1601 CNC(C)c1ccc2ccccc2n1 269862a_106832991636_100000684817 [0,1,0,0,0,0|2,0,1]=4 146 B15R2.1601 COC(C)c1ccc2ccccc2c1 34a_100011215343_200000210301 [0,1,0,0,0,0|2,0,1]=4 147 B15R2.1601 COC(C)c1ccc2ccccc2c1 7a_100011215343_200000210301 [0,1,0,0,0,0|2,0,1]=4 148 B15R2.1601 O=C(CF)c1ccc2ccccc2c1 1458a_100000210637_100015361967 [0,1,0,0,0,0|2,0,0]=3 149 B15R2.1601 O=C(CF)c1ccc2cccnc2c1 1458a_100011933907_100015361967 [0,1,0,0,0,0|3,0,0]=4 150 B15R2.1601 O=C(CF)c1ccc2ccncc2c1 1458a_100000070124_100015361967 [0,1,0,0,0,0|3,0,0]=4 151 B15R2.1601 O=C(CF)c1ccc2cnccc2c1 1458a_100011935275_100015361967 [0,1,0,0,0,0|3,0,0]=4 152 B15R2.1601 O=C(CF)c1ccc2ncccc2c1 1458a_100011216044_100015361967 [0,1,0,0,0,0|3,0,0]=4 153 B15R2.7174 C=C(C)c1ccc2ccc(cc2c1)N 271570a_100000694244_100010090036 [0,1,0,0,0,0|3,0,0]=4 154 B15R2.7174 C=C(C)c1ccc2ccc(cc2c1)O 271570a_100000694244_100009816537 [0,1,0,0,0,0|3,0,0]=4 155 B15R2.7174 C=C(C)c1ccc2ccc(cc2n1)O 271570a_100000694244_100000079174 [0,1,0,0,0,0|2,0,0]=3 156 B15R2.7174 C=C(C)c1ccc2ccc(nc2n1)N 271570a_100000694244_100000117679 [0,1,0,0,0,0|3,0,0]=4 157 B15R2.7174 C=C(C)c1ccc2ccc(nc2n1)O 271570a_100000694244_200010218124 [0,1,0,0,0,0|3,0,0]=4 158 B15R2.7174 C=C(C)c1ccc2ncc(cc2n1)F 271570a_100000694244_100009889179 [0,1,0,0,0,0|3,0,0]=4 159 B15R2.7174 C=C(C)c1cnc2ccc(cc2n1)O 271570a_100000694244_200020640061 [0,1,0,0,0,0|3,0,0]=4 160 B15R2.7174 C=C(C)c1ncc2ccc(cc2n1)F 271570a_100000694244_100000104070 [0,1,0,0,0,0|3,0,0]=4 161 B15R2.7174 CC(=O)c1ccc2ccc(cc2c1)Br 1458a_200010152650_200000210301 [0,1,0,0,0,0|2,0,0]=3 162 B15R2.7174 CC(=O)c1ccc2ncc(cc2c1)Br 1458a_100010130286_200000210301 [0,1,0,0,0,0|3,0,0]=4 163 B15R2.7174 CC(=O)c1ccc2ncc(cc2c1)O 271570a_203496583355_100010254247 [0,1,0,0,0,0|3,0,0]=4 164 B15R2.7174 [13CH3]C(=O)c1ccc2ccc(cc2c1)Br 1458a_200010152650_200025704644 [0,1,0,0,0,0|2,0,0]=3 165 B15R2.7174 [13CH3]C(=O)c1ccc2ncc(cc2c1)Br 1458a_100010130286_200025704644 [0,1,0,0,0,0|3,0,0]=4 166 B15R2.7180 C=C(C)c1ccc2cc(ccc2c1)Br 271570a_100000694244_100012344972 [0,1,0,0,0,0|3,0,0]=4 167 B15R2.7180 C=C(C)c1ccc2cc(ccc2c1)F 271570a_100000694244_100009817052 [0,1,0,0,0,0|3,0,0]=4 168 B15R2.7180 C=C(C)c1ccc2cc(ccc2c1)N 271570a_100000694244_100000185457 [0,1,0,0,0,0|3,0,0]=4 169 B15R2.7180 C=C(C)c1ccc2cc(ccc2c1)O 271570a_100000694244_100000185455 [0,1,0,0,0,0|3,0,0]=4 170 B15R2.7180 C=C(C)c1ccc2cc(ccc2n1)C 271570a_100000694244_100011865911 [0,1,0,0,0,0|2,0,0]=3 171 B15R2.7180 C=C(C)c1ccc2cc(ccc2n1)F 271570a_100000694244_100011998705 [0,1,0,0,0,0|2,0,0]=3 172 B15R2.7180 C=C(C)c1ccc2cc(ccc2n1)O 271570a_100000694244_100009849208 [0,1,0,0,0,0|2,0,0]=3 173 B15R2.7180 C=C(C)c1ccc2nc(ccc2n1)C 271570a_100000694244_200009884078 [0,1,0,0,0,0|3,0,0]=4 174 B15R2.7180 C=C(C)c1cnc2cc(ccc2n1)F 271570a_100000694244_100000098432 [0,1,0,0,0,0|3,0,0]=4 175 B15R2.7180 C=C(C)c1cnc2cc(ccc2n1)N 271570a_100000694244_100009885871 [0,1,0,0,0,0|3,0,0]=4 176 B15R2.7180 C=C(C)c1cnc2cc(ccc2n1)O 271570a_100000694244_200010664160 [0,1,0,0,0,0|3,0,0]=4 177 B15R2.7180 CC(=O)c1ccc2cc(ccc2c1)Br 1458a_100000759775_200000210301 [0,1,0,0,0,0|2,0,0]=3 178 B15R2.7180 CC(=O)c1ccc2cc(ccc2c1)Cl 1458a_200010245464_200000210301 [0,1,0,0,0,0|2,0,0]=3 179 B15R2.7180 CC(=O)c1ccc2cc(ccc2c1)F 1458a_200000042716_200000210301 [0,1,0,0,0,0|2,0,0]=3 180 B15R2.7180 CC(=O)c1ccc2cc(ccc2c1)O 271570a_203496583355_100012339427 [0,1,0,0,0,0|2,0,0]=3 181 B15R2.7180 CC(=O)c1ccc2nc(ccc2c1)C 1458a_100000691375_200000210301 [0,1,0,0,0,0|3,0,0]=4 182 B15R2.7180 CC(=O)c1ccc2nc(ccc2c1)Cl 1458a_100000740145_200000210301 [0,1,0,0,0,0|3,0,0]=4 183 B15R2.7180 CC(=O)c1ccc2nc(ccc2c1)O 1458a_100015838258_200000210301 [0,1,0,0,0,0|3,0,0]=4 184 B15R2.7180 CC(=O)c1ccc2oc(=O)ccc2c1 1458a_200000082590_200000210301 [0,1,0,0,0,0|3,0,0]=4 185 B15R2.7180 CN(C)c1ccc2cc(ccc2n1)F 27a_100102631434_100011998705 [0,1,0,0,0,0|3,0,0]=4 186 B15R2.7180 Cc1ccc2cc(ccc2n1)C(=O)[13CH3] 1458a_100000691375_200025704644 [0,1,0,0,0,0|3,0,0]=4 187 B15R2.7180 Cc1ccc2nc(ccc2c1)N(C)C 27a_100102631434_100011865911 [0,1,0,0,0,0|3,0,0]=4 188 B15R2.7180 OB(O)c1ccc2cc(ccc2c1)O 271570a_203496583355_100010152634 [0,1,0,0,0,0|2,0,1]=4 189 B15R2.7180 [13CH3]C(=O)c1ccc2cc(ccc2c1)Br 1458a_100000759775_200025704644 [0,1,0,0,0,0|2,0,0]=3 190 B15R2.7180 [13CH3]C(=O)c1ccc2cc(ccc2c1)Cl 1458a_200010245464_200025704644 [0,1,0,0,0,0|2,0,0]=3 191 B15R2.7180 [13CH3]C(=O)c1ccc2cc(ccc2c1)F 1458a_200000042716_200025704644 [0,1,0,0,0,0|2,0,0]=3 192 B15R2.7180 [13CH3]C(=O)c1ccc2nc(ccc2c1)Cl 1458a_100000740145_200025704644 [0,1,0,0,0,0|3,0,0]=4 193 B15R2.7180 [13CH3]C(=O)c1ccc2nc(ccc2c1)O 1458a_100015838258_200025704644 [0,1,0,0,0,0|3,0,0]=4 194 B15R2.7180 [13CH3]C(=O)c1ccc2oc(=O)ccc2c1 1458a_200000082590_200025704644 [0,1,0,0,0,0|3,0,0]=4 195 B15R2.13598 C=C(C)c1ccc2c(cccc2c1)N 271570a_100000694244_100010090037 [0,1,0,0,0,0|3,0,0]=4 196 B15R2.13598 C=C(C)c1ccc2c(cccc2c1)O 271570a_100000694244_100010202202 [0,1,0,0,0,0|3,0,0]=4 197 B15R2.13598 CC(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_200000210301 [0,1,0,0,0,0|3,0,0]=4 198 B15R2.13598 CC(=O)c1ccc2c(cccc2c1)Br 1458a_100000691321_200000210301 [0,1,0,0,0,0|2,0,0]=3 199 B15R2.13598 CC(=O)c1ccc2c(cccc2c1)Cl 1458a_100010089951_200000210301 [0,1,0,0,0,0|2,0,0]=3 200 B15R2.13598 CC(=O)c1ccc2c(ccnc2c1)Cl 1458a_100010240032_200000210301 [0,1,0,0,0,0|3,0,0]=4 201 B15R2.13598 CC(=O)c1ccc2c(nccc2c1)Cl 1458a_100010201666_200000210301 [0,1,0,0,0,0|3,0,0]=4 202 B15R2.13598 [13CH3]C(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_200025704644 [0,1,0,0,0,0|3,0,0]=4 203 B15R2.13598 [13CH3]C(=O)c1ccc2c(cccc2c1)Br 1458a_100000691321_200025704644 [0,1,0,0,0,0|2,0,0]=3 204 B15R2.13598 [13CH3]C(=O)c1ccc2c(cccc2c1)Cl 1458a_100010089951_200025704644 [0,1,0,0,0,0|2,0,0]=3 205 B15R2.13598 [13CH3]C(=O)c1ccc2c(ccnc2c1)Cl 1458a_100010240032_200025704644 [0,1,0,0,0,0|3,0,0]=4 206 B15R2.13598 [13CH3]C(=O)c1ccc2c(nccc2c1)Cl 1458a_100010201666_200025704644 [0,1,0,0,0,0|3,0,0]=4 207 B15R2.14951 C=C(C)c1cc(=O)c2ccccc2[nH]1 271570a_100000694244_100000090176 [0,1,0,0,0,0|2,0,1]=4 208 B15R2.14951 C=C(C)c1cc(=O)n2ccccc2n1 271570a_100000694244_100000707704 [0,1,0,0,0,0|3,0,0]=4 209 B15R2.14951 C=C(C)c1cc(c2ccccc2c1)N 271570a_100000694244_100010171453 [0,1,0,0,0,0|3,0,0]=4 210 B15R2.14951 C=C(C)c1cc(c2ccccc2c1)O 271570a_100000694244_100010089979 [0,1,0,0,0,0|3,0,0]=4 211 B15R2.14951 C=C(C)c1cc(c2ccccc2n1)C 271570a_100000694244_100012354972 [0,1,0,0,0,0|2,0,0]=3 212 B15R2.14951 C=C(C)c1cc(c2ccccc2n1)N 271570a_100000694244_100010197925 [0,1,0,0,0,0|2,0,0]=3 213 B15R2.14951 C=C(C)c1nc(c2ccccc2n1)C 271570a_100000694244_100000046098 [0,1,0,0,0,0|3,0,0]=4 214 B15R2.14951 CC(=O)c1cc(c2ncccc2c1)O 1458a_200009880037_200000210301 [0,1,0,0,0,0|3,0,0]=4 215 B15R2.14951 Cc1cc(nc2c1cccc2)N(C)C 27a_100102631434_100000184993 [0,1,0,0,0,0|3,0,0]=4 216 B15R2.14951 [13CH3]C(=O)c1cc(c2ncccc2c1)O 1458a_200009880037_200025704644 [0,1,0,0,0,0|3,0,0]=4 217 B15R2.61353 C=C(C)c1ccc2cccc(c2c1)C 271570a_100000694244_100010089936 [0,1,0,0,0,0|3,0,0]=4 218 B15R2.61353 C=C(C)c1ccc2cccc(c2c1)N 271570a_100000694244_100010090012 [0,1,0,0,0,0|3,0,0]=4 219 B15R2.61353 C=C(C)c1ccc2cccc(c2c1)O 271570a_100000694244_100010089991 [0,1,0,0,0,0|3,0,0]=4 220 B15R2.61353 C=C(C)c1ccc2cccc(c2n1)C 271570a_100000694244_100012002297 [0,1,0,0,0,0|2,0,0]=3 221 B15R2.61353 C=C(C)c1ccc2cccc(c2n1)F 271570a_100000694244_100012017632 [0,1,0,0,0,0|2,0,0]=3 222 B15R2.61353 C=C(C)c1ccc2cccc(c2n1)O 271570a_100000694244_100010153751 [0,1,0,0,0,0|2,0,0]=3 223 B15R2.61353 C=C(C)c1ncc2cccc(c2n1)O 271570a_100000694244_100010674811 [0,1,0,0,0,0|3,0,0]=4 224 B15R2.61353 CC(=O)c1ccc2[nH]ccc(=O)c2c1 1458a_200009839989_200000210301 [0,1,0,0,0,0|3,0,0]=4 225 B15R2.61353 CC(=O)c1ccc2cncc(c2c1)Br 1458a_100015832970_200000210301 [0,1,0,0,0,0|3,0,0]=4 226 B15R2.61353 CC(=O)c1ccc2nccc(c2c1)Br 1458a_200010240029_200000210301 [0,1,0,0,0,0|3,0,0]=4 227 B15R2.61353 CN(C)c1ccc2cccc(c2n1)O 27a_100102631434_100010153751 [0,1,0,0,0,0|3,0,0]=4 228 B15R2.61353 Cc1cccc2c1nc(cc2)N(C)C 27a_100102631434_100012002297 [0,1,0,0,0,0|3,0,0]=4 229 B15R2.61353 [13CH3]C(=O)c1ccc2[nH]ccc(=O)c2c1 1458a_200009839989_200025704644 [0,1,0,0,0,0|3,0,0]=4 230 B15R2.61353 [13CH3]C(=O)c1ccc2cncc(c2c1)Br 1458a_100015832970_200025704644 [0,1,0,0,0,0|3,0,0]=4 231 B15R2.61353 [13CH3]C(=O)c1ccc2nccc(c2c1)Br 1458a_200010240029_200025704644 [0,1,0,0,0,0|3,0,0]=4 232 B13R1.74 C=CCOc1ccc(nc1)C(=O)C 34a_100012001710_100015514636 [0,0,1,0,0,0|2,0,1]=4 233 B13R1.74 C=CCOc1ccc(nc1)C(=O)C 7a_100012001710_100015514636 [0,0,1,0,0,0|2,0,1]=4 234 B13R1.74 C=CCSc1ccc(nc1)C(=O)C 62a_100000210623_100000686046 [0,0,1,0,0,0|2,0,1]=4 235 B13R1.74 C=CCSc1ccc(nc1)C(=O)C 62a_100000686046_100000210623 [0,0,1,0,0,0|2,0,1]=4 236 B13R1.74 C=CCSc1ccc(nc1)C(=O)N 62a_100000210623_100011219284 [0,0,1,0,0,0|2,0,1]=4 237 B13R1.74 C=CCSc1ccc(nc1)C(=O)N 62a_100011219284_100000210623 [0,0,1,0,0,0|2,0,1]=4 238 B13R1.90 C=Cc1ccccc1CCC(=O)N 271570a_100011290941_100009814947 [0,0,1,0,0,0|2,0,1]=4 239 B13R1.90 C=Cc1ccccc1CNC(=O)C 271570a_100011290941_100011237613 [0,0,1,0,0,0|3,0,0]=4 240 B13R1.90 C=Cc1ccccc1NCC(=O)N 34a_100012022501_100000187820 [0,0,1,0,0,0|1,0,2]=4 241 B13R1.90 C=Cc1ccccc1NCC(=O)[O-] 34a_100012022501_100020667443 [0,0,1,0,0,0|0,0,3]=4 242 B13R1.90 C=Cc1ccccc1OCC(=O)N 271570a_100011290941_200000148491 [0,0,1,0,0,0|2,0,1]=4 243 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100000747473_100011218376 [0,0,1,0,0,0|2,0,1]=4 244 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100011218376_100000747473 [0,0,1,0,0,0|2,0,1]=4 245 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100011218376_100020667443 [0,0,1,0,0,0|1,0,2]=4 246 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100011218376 [0,0,1,0,0,0|1,0,2]=4 247 B13R1.568 C=CCNc1cccc(n1)C(=O)C 27a_100020586998_100000085735 [0,0,1,0,0,0|2,0,1]=4 248 B13R1.568 C=CCNc1cccc(n1)C(=O)N 27a_100020586998_100011834053 [0,0,1,0,0,0|2,0,1]=4 249 B13R1.568 C=CCSc1cccc(n1)C(=O)C 62a_100000210623_100009816502 [0,0,1,0,0,0|2,0,1]=4 250 B13R1.568 C=CCSc1cccc(n1)C(=O)C 62a_100009816502_100000210623 [0,0,1,0,0,0|2,0,1]=4 251 B13R1.568 C=CCSc1cccc(n1)C(=O)N 62a_100000210623_100011834053 [0,0,1,0,0,0|2,0,1]=4 252 B13R1.568 C=CCSc1cccc(n1)C(=O)N 62a_100011834053_100000210623 [0,0,1,0,0,0|2,0,1]=4 253 B15R3.31603 c1ccc2nc(ccc2c1)C3CC3 271570a_100011220607_100011291633 [0,0,0,1,0,0|2,0,1]=4 254 B13R2.72 C=C(C)c1coc2c1cccc2 271570a_100000694244_100009812202 [0,0,0,0,1,0|3,0,0]=4 255 B13R2.72 C=C(C)c1csc2c1cccc2 271570a_100000694244_100009813928 [0,0,0,0,1,0|3,0,0]=4 256 B13R2.72 CC(=O)C1=CCc2c1cccc2 1458a_100000037392_200000210301 [0,0,0,0,1,0|1,0,1]=3 257 B13R2.72 CC(=O)C1C=Cc2c1cccc2 1458a_200009832160_200000210301 [0,0,0,0,1,0|1,0,1]=3 258 B13R2.72 [13CH3]C(=O)C1=CCc2c1cccc2 1458a_100000037392_200025704644 [0,0,0,0,1,0|1,0,1]=3 259 B13R2.72 [13CH3]C(=O)C1C=Cc2c1cccc2 1458a_200009832160_200025704644 [0,0,0,0,1,0|1,0,1]=3 260 B13R2.430 C=C(C)c1ccc2[nH]ccc2n1 271570a_100000694244_100000087148 [0,0,0,0,1,0|3,0,0]=4 261 B13R2.430 C=C(C)c1ccc2cc[nH]c2n1 271570a_100000694244_100009814870 [0,0,0,0,1,0|3,0,0]=4 262 B13R2.430 C=C(C)c1ccc2occc2n1 271570a_100000694244_100009851292 [0,0,0,0,1,0|3,0,0]=4 263 B13R2.430 C=C(C)c1ccc2sccc2n1 271570a_100000694244_100012000956 [0,0,0,0,1,0|3,0,0]=4 264 B13R2.430 CC(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200000210301 [0,0,0,0,1,0|3,0,0]=4 265 B13R2.430 CC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200000210301 [0,0,0,0,1,0|3,0,0]=4 266 B13R2.430 CC(=O)c1ccc2ccoc2c1 1458a_100000077109_200000210301 [0,0,0,0,1,0|3,0,0]=4 267 B13R2.430 CC(=O)c1ccc2ccsc2c1 1458a_100000045399_200000210301 [0,0,0,0,1,0|3,0,0]=4 268 B13R2.430 CC(=O)c1ccc2occc2c1 1458a_100000039204_200000210301 [0,0,0,0,1,0|3,0,0]=4 269 B13R2.430 CC(=O)c1ccc2sccc2c1 1458a_100000766740_200000210301 [0,0,0,0,1,0|3,0,0]=4 270 B13R2.430 [13CH3]C(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200025704644 [0,0,0,0,1,0|3,0,0]=4 271 B13R2.430 [13CH3]C(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200025704644 [0,0,0,0,1,0|3,0,0]=4 272 B13R2.430 [13CH3]C(=O)c1ccc2ccoc2c1 1458a_100000077109_200025704644 [0,0,0,0,1,0|3,0,0]=4 273 B13R2.430 [13CH3]C(=O)c1ccc2ccsc2c1 1458a_100000045399_200025704644 [0,0,0,0,1,0|3,0,0]=4 274 B13R2.430 [13CH3]C(=O)c1ccc2occc2c1 1458a_100000039204_200025704644 [0,0,0,0,1,0|3,0,0]=4 275 B13R2.430 [13CH3]C(=O)c1ccc2sccc2c1 1458a_100000766740_200025704644 [0,0,0,0,1,0|3,0,0]=4 276 B13R2.435 C=C(C)c1cc2ccccc2[nH]1 271570a_100000694244_100010232065 [0,0,0,0,1,0|2,0,1]=4 277 B13R2.435 C=C(C)c1cc2ccccc2o1 271570a_100000694244_100010159458 [0,0,0,0,1,0|3,0,0]=4 278 B13R2.435 C=C(C)c1cc2ccccc2s1 271570a_100000694244_100009816949 [0,0,0,0,1,0|3,0,0]=4 279 B13R2.435 C=C(C)c1cn2ccccc2n1 271570a_100000694244_100009819586 [0,0,0,0,1,0|3,0,0]=4 280 B13R2.435 C=C(C)c1nc2ccccc2[nH]1 271570a_100000694244_100009814255 [0,0,0,0,1,0|3,0,0]=4 281 B13R2.435 C=C(C)c1nc2ccccc2s1 271570a_100000694244_100000751744 [0,0,0,0,1,0|3,0,0]=4 282 B13R2.435 CC(=O)C1=Cc2ccccc2C1 1458a_100009862756_200000210301 [0,0,0,0,1,0|2,0,0]=3 283 B13R2.435 [13CH3]C(=O)C1=Cc2ccccc2C1 1458a_100009862756_200025704644 [0,0,0,0,1,0|2,0,0]=3 284 B15R2.1237 CC(=O)C1=Cc2ccccc2OC=C1 1458a_200000089061_200000210301 [0,0,0,0,0,1|2,0,0]=3 285 B15R2.1237 [13CH3]C(=O)C1=Cc2ccccc2OC=C1 1458a_200000089061_200025704644 [0,0,0,0,0,1|2,0,0]=3 286 B15R2.1668 CC(=Cc1ccc2ccccc2c1)C 271570a_100102525489_100000233703 [0,0,0,0,0,1|3,0,0]=4 287 B15R2.1668 CC(=Cc1ccc2ccccc2n1)C 271570a_100102525489_100011291633 [0,0,0,0,0,1|2,0,0]=3 288 B15R2.1668 CC(=Cc1ccc2cccnc2n1)C 271570a_100102525489_100009888989 [0,0,0,0,0,1|3,0,0]=4 289 B15R2.1668 CC(=Cc1ccc2ccncc2n1)C 271570a_100102525489_100000020162 [0,0,0,0,0,1|3,0,0]=4 290 B15R2.1668 CC(=Cc1ccc2ncccc2n1)C 271570a_100102525489_100000073381 [0,0,0,0,0,1|3,0,0]=4 291 B15R2.1668 CC(=Cc1cnc2ccccc2n1)C 271570a_100102525489_100000756483 [0,0,0,0,0,1|3,0,0]=4 292 B15R2.1668 CC(=Cc1ncc2ccccc2n1)C 271570a_100102525489_100000097389 [0,0,0,0,0,1|3,0,0]=4 293 B15R2.1668 CC(=O)Cc1cc2ccccc2cn1 1458a_100000070787_100009869231 [0,0,0,0,0,1|3,0,0]=4 294 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 1458a_100000070787_100011216711 [0,0,0,0,0,1|2,0,0]=3 295 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 1458a_100000181716_200000210301 [0,0,0,0,0,1|2,0,0]=3 296 B15R2.1668 CC(=O)Cc1ccc2ccccc2n1 1458a_100000070787_100000737579 [0,0,0,0,0,1|1,0,0]=2 297 B15R2.1668 CC(=O)Cc1ccc2cnccc2c1 1458a_100000070787_100020605334 [0,0,0,0,0,1|3,0,0]=4 298 B15R2.1668 CC(=O)Cc1ccc2ncccc2c1 1458a_100000070787_100000703657 [0,0,0,0,0,1|3,0,0]=4 299 B15R2.1668 CC(=O)Cc1ccc2ncccc2c1 1458a_100011218584_200000210301 [0,0,0,0,0,1|3,0,0]=4 300 B15R2.1668 CC(=O)Cc1cnc2ccccc2n1 1458a_100000070787_200000751123 [0,0,0,0,0,1|2,0,0]=3 301 B15R2.1668 CC(=O)Cc1ncc2ccccc2n1 1458a_100000070787_100009868571 [0,0,0,0,0,1|2,0,0]=3 302 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 11a_100000211940_100015343762 [0,0,0,0,0,1|2,0,0]=3 303 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 1626a_100000211940_100015343762 [0,0,0,0,0,1|2,0,0]=3 304 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 22a_100000211940_100000070787 [0,0,0,0,0,1|2,0,0]=3 305 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 527a_100000211940_100103153847 [0,0,0,0,0,1|2,0,0]=3 306 B15R2.1668 CC(=O)Nc1ccc2cccnc2c1 11a_100102887122_100015343762 [0,0,0,0,0,1|3,0,0]=4 307 B15R2.1668 CC(=O)Nc1ccc2cccnc2c1 1626a_100102887122_100015343762 [0,0,0,0,0,1|3,0,0]=4 308 B15R2.1668 CC(=O)Nc1ccc2cccnc2c1 22a_100102887122_100000070787 [0,0,0,0,0,1|3,0,0]=4 309 B15R2.1668 CC(=O)Nc1ccc2cccnc2c1 527a_100102887122_100103153847 [0,0,0,0,0,1|3,0,0]=4 310 B15R2.1668 CC(=O)Nc1ccc2ccncc2c1 11a_100000069342_100015343762 [0,0,0,0,0,1|3,0,0]=4 311 B15R2.1668 CC(=O)Nc1ccc2ccncc2c1 1626a_100000069342_100015343762 [0,0,0,0,0,1|3,0,0]=4 312 B15R2.1668 CC(=O)Nc1ccc2ccncc2c1 22a_100000069342_100000070787 [0,0,0,0,0,1|3,0,0]=4 313 B15R2.1668 CC(=O)Nc1ccc2ccncc2c1 527a_100000069342_100103153847 [0,0,0,0,0,1|3,0,0]=4 314 B15R2.1668 CC(=O)Nc1ccc2cnccc2c1 11a_100000039641_100015343762 [0,0,0,0,0,1|3,0,0]=4 315 B15R2.1668 CC(=O)Nc1ccc2cnccc2c1 1626a_100000039641_100015343762 [0,0,0,0,0,1|3,0,0]=4 316 B15R2.1668 CC(=O)Nc1ccc2cnccc2c1 22a_100000039641_100000070787 [0,0,0,0,0,1|3,0,0]=4 317 B15R2.1668 CC(=O)Nc1ccc2cnccc2c1 527a_100000039641_100103153847 [0,0,0,0,0,1|3,0,0]=4 318 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 11a_100011198106_100015343762 [0,0,0,0,0,1|3,0,0]=4 319 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 1626a_100011198106_100015343762 [0,0,0,0,0,1|3,0,0]=4 320 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 22a_100011198106_100000070787 [0,0,0,0,0,1|3,0,0]=4 321 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 527a_100011198106_100103153847 [0,0,0,0,0,1|3,0,0]=4 322 B15R2.1668 CC(C)Nc1ccc2ccccc2n1 27a_100138425928_100011291633 [0,0,0,0,0,1|2,0,1]=4 323 B15R2.1668 CC(C)Sc1ccc2ccccc2n1 62a_100000210206_100011291633 [0,0,0,0,0,1|2,0,1]=4 324 B15R2.1668 CC(C)Sc1ccc2ccccc2n1 62a_100011291633_100000210206 [0,0,0,0,0,1|2,0,1]=4 325 B15R2.1668 CN(C)Cc1ccc2ccccc2n1 2230a_100102631434_100000737579 [0,0,0,0,0,1|3,0,0]=4 326 B15R2.1668 CN(C)Cc1ccc2ccccc2n1 270004a_100102631434_100000759686 [0,0,0,0,0,1|3,0,0]=4 327 B15R2.1668 [13CH3]C(=O)Cc1ccc2ccccc2c1 1458a_100000181716_200025704644 [0,0,0,0,0,1|2,0,0]=3 328 B15R2.1668 [13CH3]C(=O)Cc1ccc2ncccc2c1 1458a_100011218584_200025704644 [0,0,0,0,0,1|3,0,0]=4 329 B12R1.71 C=CCSc1ccc(nc1)C=O 62a_100000210623_100000754260 [1,0,1,0,0,0|1,0,1]=4 330 B12R1.71 C=CCSc1ccc(nc1)C=O 62a_100000754260_100000210623 [1,0,1,0,0,0|1,0,1]=4 331 B12R1.113 C=C=Cc1ccc(nc1)C(=O)C 271570a_100015277604_100000686046 [1,0,1,0,0,0|1,0,1]=4 332 B12R1.113 C=C=Cc1ccc(nc1)C(=O)N 271570a_100015277604_100011219284 [1,0,1,0,0,0|1,0,1]=4 333 B12R1.113 CC=Cc1ccc(nc1)C(=O)C 271570a_100016259895_100000686046 [1,0,1,0,0,0|1,0,1]=4 334 B12R1.113 CC=Cc1ccc(nc1)C(=O)N 271570a_100016259895_100011219284 [1,0,1,0,0,0|1,0,1]=4 335 B12R1.121 C=Cc1ccccc1CCC=O 271570a_100011290941_100011713448 [1,0,1,0,0,0|1,0,1]=4 336 B12R1.121 C=Cc1ccccc1NCC=O 34a_100012022501_200009817547 [1,0,1,0,0,0|0,0,2]=4 337 B12R1.121 C=Cc1ccccc1SCC=O 62a_100011218376_200015260668 [1,0,1,0,0,0|1,0,1]=4 338 B12R1.121 C=Cc1ccccc1SCC=O 62a_200015260668_100011218376 [1,0,1,0,0,0|1,0,1]=4 339 B12R1.114 C=C=Cc1ccc(nc1C)C=O 271570a_100015277604_100010238520 [1,0,1,0,0,0|0,0,2]=4 340 B12R1.114 CC=Cc1ccc(nc1C)C=O 271570a_100016259895_100010238520 [1,0,1,0,0,0|0,0,2]=4 341 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [1,0,1,0,0,0|1,0,1]=4 342 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [1,0,1,0,0,0|1,0,1]=4 343 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [1,0,1,0,0,0|2,0,0]=4 344 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [1,0,1,0,0,0|1,0,1]=4 345 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [1,0,1,0,0,0|2,0,0]=4 346 B12R1.279 C=C=Cc1cccc(n1)C(=O)C 271570a_100015277604_100009816502 [1,0,1,0,0,0|1,0,1]=4 347 B12R1.279 C=C=Cc1cccc(n1)C(=O)N 271570a_100015277604_100011834053 [1,0,1,0,0,0|1,0,1]=4 348 B12R1.279 CC=Cc1cccc(n1)C(=O)C 271570a_100016259895_100009816502 [1,0,1,0,0,0|1,0,1]=4 349 B12R1.279 CC=Cc1cccc(n1)C(=O)N 271570a_100016259895_100011834053 [1,0,1,0,0,0|1,0,1]=4 350 B12R1.382 C=CCSc1cccc(n1)C=O 62a_100000210623_100000688028 [1,0,1,0,0,0|1,0,1]=4 351 B12R1.382 C=CCSc1cccc(n1)C=O 62a_100000688028_100000210623 [1,0,1,0,0,0|1,0,1]=4 352 B12R1.78 C=Cc1cc(ccc1C=O)C=O 271570a_100011290941_100015597013 [1,0,1,0,0,0|2,0,0]=4 353 B12R1.78 C=Cc1nc(ccc1OC)C=O 271570a_100011290941_100010174741 [1,0,1,0,0,0|1,0,1]=4 354 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [2,0,0,0,0,0|2,0,0]=4 355 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [2,0,0,0,0,0|1,0,0]=3 356 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [2,0,0,0,0,0|0,0,0]=2 357 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [2,0,0,0,0,0|2,0,0]=4 358 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [2,0,0,0,0,0|1,0,0]=3 359 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [2,0,0,0,0,0|2,0,0]=4 360 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [2,0,0,0,0,0|1,0,0]=3 361 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [2,0,0,0,0,0|2,0,0]=4 362 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [2,0,0,0,0,0|2,0,0]=4 363 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [2,0,0,0,0,0|1,0,0]=3 364 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [2,0,0,0,0,0|2,0,0]=4 365 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [2,0,0,0,0,0|2,0,0]=4 366 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [2,0,0,0,0,0|1,0,0]=3 367 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [2,0,0,0,0,0|2,0,0]=4 368 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [2,0,0,0,0,0|1,0,0]=3 369 B14R1.65 C=CCOc1ccc(nc1)C(=O)OC 34a_100011997255_100015514636 [0,1,1,0,0,0|1,0,1]=4 370 B14R1.65 C=CCOc1ccc(nc1)C(=O)OC 7a_100011997255_100015514636 [0,1,1,0,0,0|1,0,1]=4 371 B14R1.65 C=CCSc1ccc(nc1)C(=O)OC 62a_100000210623_100102712061 [0,1,1,0,0,0|1,0,1]=4 372 B14R1.65 C=CCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210623 [0,1,1,0,0,0|1,0,1]=4 373 B14R1.462 C=CCNCc1ccc(nc1)C(=O)O 269956a_100000762669_100000210623 [0,1,1,0,0,0|0,0,2]=4 374 B14R1.863 C=Cc1ccccc1/C=C/C(=O)OC 271570a_100011290941_100000151022 [0,1,1,0,0,0|1,0,0]=3 375 B14R1.863 C=Cc1ccccc1CCC(=O)OC 271570a_100011290941_100009815308 [0,1,1,0,0,0|1,0,1]=4 376 B14R1.863 C=Cc1ccccc1NCC(=O)OC 34a_100012022501_100000747449 [0,1,1,0,0,0|0,0,2]=4 377 B14R1.863 C=Cc1ccccc1OCC(=O)OC 271570a_100011290941_200000173920 [0,1,1,0,0,0|1,0,1]=4 378 B14R1.863 C=Cc1ccccc1SCC(=O)OC 62a_100000747449_100011218376 [0,1,1,0,0,0|1,0,1]=4 379 B14R1.863 C=Cc1ccccc1SCC(=O)OC 62a_100011218376_100000747449 [0,1,1,0,0,0|1,0,1]=4 380 B14R1.3135 C=Cc1ccccc1NC(=O)C(=O)N 22a_100012022501_100011215815 [0,1,1,0,0,0|1,0,1]=4 381 B14R1.6720 C=C=Cc1ccc(nc1C)C(=O)OC 271570a_100015277604_100010207261 [0,1,1,0,0,0|0,0,2]=4 382 B14R1.6720 C=C=Cc1ccc(nc1F)C(=O)OC 271570a_100015277604_100010189630 [0,1,1,0,0,0|1,0,1]=4 383 B14R1.6720 C=C=Cc1ccc(nc1N)C(=O)OC 271570a_100015277604_100010187631 [0,1,1,0,0,0|1,0,1]=4 384 B14R1.6720 C=C=Cc1ccc(nc1O)C(=O)OC 271570a_100015277604_100010189637 [0,1,1,0,0,0|1,0,1]=4 385 B14R1.6720 CC=Cc1ccc(nc1C)C(=O)OC 271570a_100016259895_100010207261 [0,1,1,0,0,0|0,0,2]=4 386 B14R1.6720 CC=Cc1ccc(nc1F)C(=O)OC 271570a_100016259895_100010189630 [0,1,1,0,0,0|1,0,1]=4 387 B14R1.6720 CC=Cc1ccc(nc1N)C(=O)OC 271570a_100016259895_100010187631 [0,1,1,0,0,0|1,0,1]=4 388 B14R1.6720 CC=Cc1ccc(nc1O)C(=O)OC 271570a_100016259895_100010189637 [0,1,1,0,0,0|1,0,1]=4 389 B14R1.436 C=C=Cc1nc(ccc1C)C(=O)OC 271570a_100015277604_100010143800 [0,1,1,0,0,0|0,0,2]=4 390 B14R1.436 C=C=Cc1nc(ccc1F)C(=O)OC 271570a_100015277604_100010189626 [0,1,1,0,0,0|1,0,1]=4 391 B14R1.436 C=C=Cc1nc(ccc1O)C(=O)OC 271570a_100015277604_200009815348 [0,1,1,0,0,0|1,0,1]=4 392 B14R1.436 CC=Cc1nc(ccc1C)C(=O)OC 271570a_100016259895_100010143800 [0,1,1,0,0,0|0,0,2]=4 393 B14R1.436 CC=Cc1nc(ccc1F)C(=O)OC 271570a_100016259895_100010189626 [0,1,1,0,0,0|1,0,1]=4 394 B14R1.436 CC=Cc1nc(ccc1O)C(=O)OC 271570a_100016259895_200009815348 [0,1,1,0,0,0|1,0,1]=4 395 B14R1.780 C=CCNc1cccc(n1)C(=O)OC 27a_100020586998_100000708286 [0,1,1,0,0,0|1,0,1]=4 396 B14R1.780 C=CCSc1cccc(n1)C(=O)OC 62a_100000210623_100000708286 [0,1,1,0,0,0|1,0,1]=4 397 B14R1.780 C=CCSc1cccc(n1)C(=O)OC 62a_100000708286_100000210623 [0,1,1,0,0,0|1,0,1]=4 398 B14R1.1864 C=Cc1cc(ccc1C=O)C(=O)OC 271570a_100011290941_100012179231 [0,1,1,0,0,0|2,0,0]=4 399 B14R1.1864 C=Cc1ccc(cc1C=O)C(=O)OC 271570a_100011290941_100012274322 [0,1,1,0,0,0|2,0,0]=4 400 B14R1.1864 C=Cc1ccc(nc1C#N)C(=O)OC 271570a_100011290941_100010187627 [0,1,1,0,0,0|1,0,1]=4 401 B14R1.1864 C=Cc1ccc(nc1OC)C(=O)OC 271570a_100011290941_100010189641 [0,1,1,0,0,0|1,0,1]=4 402 B14R1.1864 C=Cc1nc(ccc1OC)C(=O)OC 271570a_100011290941_100010205418 [0,1,1,0,0,0|1,0,1]=4 403 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [1,1,0,0,0,0|2,0,0]=4 404 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [1,1,0,0,0,0|2,0,0]=4 405 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [1,1,0,0,0,0|2,0,0]=4 406 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [1,1,0,0,0,0|2,0,0]=4 407 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [1,1,0,0,0,0|2,0,0]=4 408 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [1,1,0,0,0,0|1,0,0]=3 409 B14R2.112 C=C=Cc1ccc2ccccc2c1 271570a_100015277604_100000233703 [1,1,0,0,0,0|2,0,0]=4 410 B14R2.112 C=C=Cc1ccc2ccccc2n1 271570a_100015277604_100011291633 [1,1,0,0,0,0|1,0,0]=3 411 B14R2.112 C=C=Cc1ccc2cccnc2n1 271570a_100015277604_100009888989 [1,1,0,0,0,0|2,0,0]=4 412 B14R2.112 C=C=Cc1ccc2ccncc2n1 271570a_100015277604_100000020162 [1,1,0,0,0,0|2,0,0]=4 413 B14R2.112 C=C=Cc1ccc2ncccc2n1 271570a_100015277604_100000073381 [1,1,0,0,0,0|2,0,0]=4 414 B14R2.112 C=C=Cc1cnc2ccccc2n1 271570a_100015277604_100000756483 [1,1,0,0,0,0|2,0,0]=4 415 B14R2.112 C=C=Cc1ncc2ccccc2n1 271570a_100015277604_100000097389 [1,1,0,0,0,0|2,0,0]=4 416 B14R2.112 CC=Cc1ccc2ccccc2c1 271570a_100016259895_100000233703 [1,1,0,0,0,0|2,0,0]=4 417 B14R2.112 CC=Cc1ccc2ccccc2n1 271570a_100016259895_100011291633 [1,1,0,0,0,0|1,0,0]=3 418 B14R2.112 CC=Cc1ccc2cccnc2n1 271570a_100016259895_100009888989 [1,1,0,0,0,0|2,0,0]=4 419 B14R2.112 CC=Cc1ccc2ccncc2n1 271570a_100016259895_100000020162 [1,1,0,0,0,0|2,0,0]=4 420 B14R2.112 CC=Cc1ccc2ncccc2n1 271570a_100016259895_100000073381 [1,1,0,0,0,0|2,0,0]=4 421 B14R2.112 CC=Cc1cnc2ccccc2n1 271570a_100016259895_100000756483 [1,1,0,0,0,0|2,0,0]=4 422 B14R2.112 CC=Cc1ncc2ccccc2n1 271570a_100016259895_100000097389 [1,1,0,0,0,0|2,0,0]=4 423 B14R2.112 CCNc1ccc2ccccc2n1 27a_100015525214_100011291633 [1,1,0,0,0,0|1,0,1]=4 424 B14R2.112 CCSc1ccc2ccccc2n1 62a_100000210202_100011291633 [1,1,0,0,0,0|1,0,1]=4 425 B14R2.112 CCSc1ccc2ccccc2n1 62a_100011291633_100000210202 [1,1,0,0,0,0|1,0,1]=4 426 B14R2.112 CNCc1ccc2ccccc2n1 207a_100102657272_100000759686 [1,1,0,0,0,0|1,0,1]=4 427 B14R2.112 CNCc1ccc2ccccc2n1 2230a_106832991635_100000737579 [1,1,0,0,0,0|1,0,1]=4 428 B14R2.112 CNCc1ccc2ccccc2n1 270004a_106832991635_100000759686 [1,1,0,0,0,0|1,0,1]=4 429 B14R2.112 CNCc1ccc2ccccc2n1 34a_100102657272_100000737579 [1,1,0,0,0,0|1,0,1]=4 430 B14R2.112 CNCc1ccc2ccccc2n1 7a_106832991635_100000737579 [1,1,0,0,0,0|1,0,1]=4 431 B14R2.112 COCc1ccc2ccccc2c1 34a_100011215330_200000210301 [1,1,0,0,0,0|1,0,1]=4 432 B14R2.112 COCc1ccc2ccccc2c1 34a_100138415774_100011216711 [1,1,0,0,0,0|1,0,1]=4 433 B14R2.112 COCc1ccc2ccccc2c1 7a_100011215330_200000210301 [1,1,0,0,0,0|1,0,1]=4 434 B14R2.112 COCc1ccc2ccccc2n1 34a_100138415774_100000737579 [1,1,0,0,0,0|0,0,1]=3 435 B14R2.112 COCc1ncc2ccccc2n1 34a_100138415774_100009868571 [1,1,0,0,0,0|1,0,1]=4 436 B14R2.112 CSCc1ccc2ccccc2n1 62a_100000737579_200000210301 [1,1,0,0,0,0|0,1,1]=4 437 B14R2.112 CSCc1ccc2ccccc2n1 62a_200000210301_100000737579 [1,1,0,0,0,0|0,1,1]=4 438 B14R2.112 FCSc1ccc2ccccc2n1 62a_100011291633_100015361967 [1,1,0,0,0,0|1,0,1]=4 439 B14R2.112 FCSc1ccc2ccccc2n1 62a_100015361967_100011291633 [1,1,0,0,0,0|1,0,1]=4 440 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 34a_100011215330_200025704644 [1,1,0,0,0,0|1,0,1]=4 441 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 7a_100011215330_200025704644 [1,1,0,0,0,0|1,0,1]=4 442 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_100000737579_200025704644 [1,1,0,0,0,0|0,1,1]=4 443 B14R2.112 [13CH3]SCc1ccc2ccccc2n1 62a_200025704644_100000737579 [1,1,0,0,0,0|0,1,1]=4 444 B14R2.134 C=Cc1ccc2ccc(cc2c1)N 271570a_100011290941_100010090036 [1,1,0,0,0,0|2,0,0]=4 445 B14R2.134 C=Cc1ccc2ccc(cc2c1)O 271570a_100011290941_100009816537 [1,1,0,0,0,0|2,0,0]=4 446 B14R2.134 C=Cc1ccc2ccc(cc2n1)O 271570a_100011290941_100000079174 [1,1,0,0,0,0|1,0,0]=3 447 B14R2.134 C=Cc1ccc2ccc(nc2n1)N 271570a_100011290941_100000117679 [1,1,0,0,0,0|2,0,0]=4 448 B14R2.134 C=Cc1ccc2ccc(nc2n1)O 271570a_100011290941_200010218124 [1,1,0,0,0,0|2,0,0]=4 449 B14R2.134 C=Cc1ccc2ncc(cc2n1)F 271570a_100011290941_100009889179 [1,1,0,0,0,0|2,0,0]=4 450 B14R2.134 C=Cc1cnc2ccc(cc2n1)O 271570a_100011290941_200020640061 [1,1,0,0,0,0|2,0,0]=4 451 B14R2.134 C=Cc1ncc2ccc(cc2n1)F 271570a_100011290941_100000104070 [1,1,0,0,0,0|2,0,0]=4 452 B14R2.134 COc1ccc2ccc(cc2n1)O 271570a_203496583355_100010248626 [1,1,0,0,0,0|2,0,0]=4 453 B14R2.134 CSc1ccc2ccc(cc2n1)O 62a_200000210301_100000079174 [1,1,0,0,0,0|2,0,0]=4 454 B14R2.134 O=Cc1ccc2ccc(cc2c1)O 271570a_203496583355_100010200085 [1,1,0,0,0,0|1,0,0]=3 455 B14R2.134 O=Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100010174008 [1,1,0,0,0,0|2,0,0]=4 456 B14R2.134 [13CH3]Sc1ccc2ccc(cc2n1)O 62a_200025704644_100000079174 [1,1,0,0,0,0|2,0,0]=4 457 B14R2.142 C=Cc1ccc2cccc(c2c1)C 271570a_100011290941_100010089936 [1,1,0,0,0,0|2,0,0]=4 458 B14R2.142 C=Cc1ccc2cccc(c2c1)N 271570a_100011290941_100010090012 [1,1,0,0,0,0|2,0,0]=4 459 B14R2.142 C=Cc1ccc2cccc(c2c1)O 271570a_100011290941_100010089991 [1,1,0,0,0,0|2,0,0]=4 460 B14R2.142 C=Cc1ccc2cccc(c2n1)C 271570a_100011290941_100012002297 [1,1,0,0,0,0|1,0,0]=3 461 B14R2.142 C=Cc1ccc2cccc(c2n1)F 271570a_100011290941_100012017632 [1,1,0,0,0,0|1,0,0]=3 462 B14R2.142 C=Cc1ccc2cccc(c2n1)O 271570a_100011290941_100010153751 [1,1,0,0,0,0|1,0,0]=3 463 B14R2.142 C=Cc1ncc2cccc(c2n1)O 271570a_100011290941_100010674811 [1,1,0,0,0,0|2,0,0]=4 464 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [1,1,0,0,0,0|2,0,0]=4 465 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [1,1,0,0,0,0|2,0,0]=4 466 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [1,1,0,0,0,0|2,0,0]=4 467 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [1,1,0,0,0,0|2,0,0]=4 468 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [1,1,0,0,0,0|2,0,0]=4 469 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [1,1,0,0,0,0|2,0,0]=4 470 B14R2.142 O=Cc1ccc2ccnc(c2c1)O 271570a_203496583355_100000094387 [1,1,0,0,0,0|2,0,0]=4 471 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [1,1,0,0,0,0|2,0,0]=4 472 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [1,1,0,0,0,0|2,0,0]=4 473 B14R2.1019 C=Cc1cc(=O)c2ccccc2[nH]1 271570a_100011290941_100000090176 [1,1,0,0,0,0|1,0,1]=4 474 B14R2.1019 C=Cc1cc(=O)n2ccccc2n1 271570a_100011290941_100000707704 [1,1,0,0,0,0|2,0,0]=4 475 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [1,1,0,0,0,0|2,0,0]=4 476 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [1,1,0,0,0,0|2,0,0]=4 477 B14R2.1019 C=Cc1cc(c2ccccc2n1)C 271570a_100011290941_100012354972 [1,1,0,0,0,0|1,0,0]=3 478 B14R2.1019 C=Cc1cc(c2ccccc2n1)N 271570a_100011290941_100010197925 [1,1,0,0,0,0|1,0,0]=3 479 B14R2.1019 C=Cc1nc(c2ccccc2n1)C 271570a_100011290941_100000046098 [1,1,0,0,0,0|2,0,0]=4 480 B14R2.1019 CNc1cc(c2ccccc2n1)C 27a_100102657272_100000184993 [1,1,0,0,0,0|2,0,0]=4 481 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [1,1,0,0,0,0|2,0,0]=4 482 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_100012354972_200000210301 [1,1,0,0,0,0|2,0,0]=4 483 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_200000210301_100000184993 [1,1,0,0,0,0|2,0,0]=4 484 B14R2.1019 CSc1cc(c2ccccc2n1)N 62a_100010197925_200000210301 [1,1,0,0,0,0|2,0,0]=4 485 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_100012354972_200025704644 [1,1,0,0,0,0|2,0,0]=4 486 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_200025704644_100000184993 [1,1,0,0,0,0|2,0,0]=4 487 B14R2.1019 [13CH3]Sc1cc(c2ccccc2n1)N 62a_100010197925_200025704644 [1,1,0,0,0,0|2,0,0]=4 488 B14R2.1128 C=Cc1cc2ccccc2cc1Br 271570a_100011290941_200010169544 [1,1,0,0,0,0|2,0,0]=4 489 B14R2.1128 C=Cc1cc2ccccc2cc1Cl 271570a_100011290941_100010152806 [1,1,0,0,0,0|2,0,0]=4 490 B14R2.1128 C=Cc1cc2ccccc2cc1N 271570a_100011290941_100009991566 [1,1,0,0,0,0|2,0,0]=4 491 B14R2.1128 C=Cc1cc2ccccc2cc1O 271570a_100011290941_100009817189 [1,1,0,0,0,0|2,0,0]=4 492 B14R2.1128 C=Cc1nc2ccccc2cc1Br 271570a_100011290941_100010072790 [1,1,0,0,0,0|1,0,0]=3 493 B14R2.1128 C=Cc1nc2ccccc2cc1C 271570a_100011290941_100000751756 [1,1,0,0,0,0|1,0,0]=3 494 B14R2.1128 C=Cc1nc2ccccc2cc1O 271570a_100011290941_200000100762 [1,1,0,0,0,0|1,0,0]=3 495 B14R2.1128 C=Cc1nc2ccccc2nc1C 271570a_100011290941_100000185947 [1,1,0,0,0,0|2,0,0]=4 496 B14R2.1128 C=Cc1nc2ccccc2nc1N 271570a_100011290941_100000009970 [1,1,0,0,0,0|2,0,0]=4 497 B14R2.1128 C=Cc1nc2ncccc2cc1C 271570a_100011290941_100009877248 [1,1,0,0,0,0|2,0,0]=4 498 B14R2.1128 CNc1nc2ccccc2cc1C 27a_100102657272_100000751756 [1,1,0,0,0,0|2,0,0]=4 499 B14R2.1128 COc1nc2ccccc2cc1O 271570a_203496583355_100009820890 [1,1,0,0,0,0|2,0,0]=4 500 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_100010072790_200000210301 [1,1,0,0,0,0|2,0,0]=4 501 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_200000210301_100010072790 [1,1,0,0,0,0|2,0,0]=4 502 B14R2.1128 CSc1nc2ccccc2cc1C 62a_200000210301_100000751756 [1,1,0,0,0,0|2,0,0]=4 503 B14R2.1128 CSc1nc2ccccc2cc1O 62a_200000210301_200000100762 [1,1,0,0,0,0|2,0,0]=4 504 B14R2.1128 Cc1cc2ccccc2nc1S[13CH3] 62a_200025704644_100000751756 [1,1,0,0,0,0|2,0,0]=4 505 B14R2.1128 O=Cc1cc2ccccc2nc1O 271570a_203496583355_100000183649 [1,1,0,0,0,0|2,0,0]=4 506 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_100010072790_200025704644 [1,1,0,0,0,0|2,0,0]=4 507 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_200025704644_100010072790 [1,1,0,0,0,0|2,0,0]=4 508 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1O 62a_200025704644_200000100762 [1,1,0,0,0,0|2,0,0]=4 509 B14R2.1801 C=Cc1ccc2c(cccc2c1)N 271570a_100011290941_100010090037 [1,1,0,0,0,0|2,0,0]=4 510 B14R2.1801 C=Cc1ccc2c(cccc2c1)O 271570a_100011290941_100010202202 [1,1,0,0,0,0|2,0,0]=4 511 B14R2.1801 N#Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010235449 [1,1,0,0,0,0|1,0,1]=4 512 B14R2.2332 C=Cc1ccc2cc(ccc2c1)Br 271570a_100011290941_100012344972 [1,1,0,0,0,0|2,0,0]=4 513 B14R2.2332 C=Cc1ccc2cc(ccc2c1)F 271570a_100011290941_100009817052 [1,1,0,0,0,0|2,0,0]=4 514 B14R2.2332 C=Cc1ccc2cc(ccc2c1)N 271570a_100011290941_100000185457 [1,1,0,0,0,0|2,0,0]=4 515 B14R2.2332 C=Cc1ccc2cc(ccc2c1)O 271570a_100011290941_100000185455 [1,1,0,0,0,0|2,0,0]=4 516 B14R2.2332 C=Cc1ccc2cc(ccc2n1)C 271570a_100011290941_100011865911 [1,1,0,0,0,0|1,0,0]=3 517 B14R2.2332 C=Cc1ccc2cc(ccc2n1)F 271570a_100011290941_100011998705 [1,1,0,0,0,0|1,0,0]=3 518 B14R2.2332 C=Cc1ccc2cc(ccc2n1)O 271570a_100011290941_100009849208 [1,1,0,0,0,0|1,0,0]=3 519 B14R2.2332 C=Cc1ccc2nc(ccc2n1)C 271570a_100011290941_200009884078 [1,1,0,0,0,0|2,0,0]=4 520 B14R2.2332 C=Cc1cnc2cc(ccc2n1)F 271570a_100011290941_100000098432 [1,1,0,0,0,0|2,0,0]=4 521 B14R2.2332 C=Cc1cnc2cc(ccc2n1)N 271570a_100011290941_100009885871 [1,1,0,0,0,0|2,0,0]=4 522 B14R2.2332 C=Cc1cnc2cc(ccc2n1)O 271570a_100011290941_200010664160 [1,1,0,0,0,0|2,0,0]=4 523 B14R2.2332 CNc1ccc2cc(ccc2n1)C 27a_100102657272_100011865911 [1,1,0,0,0,0|2,0,0]=4 524 B14R2.2332 CNc1ccc2cc(ccc2n1)F 27a_100102657272_100011998705 [1,1,0,0,0,0|2,0,0]=4 525 B14R2.2332 CNc1ccc2cc(ccc2n1)O 271570a_203496583355_200012034361 [1,1,0,0,0,0|2,0,0]=4 526 B14R2.2332 COc1ccc2cc(ccc2n1)O 271570a_203496583355_100009817092 [1,1,0,0,0,0|2,0,0]=4 527 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000181977_200000210301 [1,1,0,0,0,0|2,0,0]=4 528 B14R2.2332 CSc1ccc2cc(ccc2n1)C 62a_200000210301_100011865911 [1,1,0,0,0,0|2,0,0]=4 529 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200000210301_100011998705 [1,1,0,0,0,0|2,0,0]=4 530 B14R2.2332 CSc1ccc2cc(ccc2n1)F 62a_200012355665_200000210301 [1,1,0,0,0,0|2,0,0]=4 531 B14R2.2332 CSc1ccc2cc(ccc2n1)O 62a_200000210301_100009849208 [1,1,0,0,0,0|2,0,0]=4 532 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200000181977_200025704644 [1,1,0,0,0,0|2,0,0]=4 533 B14R2.2332 Cc1ccc2nc(ccc2c1)S[13CH3] 62a_200025704644_100011865911 [1,1,0,0,0,0|2,0,0]=4 534 B14R2.2332 N#Cc1ccc2cc(ccc2n1)O 271570a_203496583355_200012353941 [1,1,0,0,0,0|1,0,1]=4 535 B14R2.2332 O=Cc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356508 [1,1,0,0,0,0|1,0,0]=3 536 B14R2.2332 O=Cc1ccc2cc(cnc2c1)O 271570a_203496583355_100010114372 [1,1,0,0,0,0|2,0,0]=4 537 B14R2.2332 O=Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100000087602 [1,1,0,0,0,0|2,0,0]=4 538 B14R2.2332 OCc1ccc2cc(ccc2c1)O 271570a_203496583355_100012356509 [1,1,0,0,0,0|1,0,1]=4 539 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200012355665_200025704644 [1,1,0,0,0,0|2,0,0]=4 540 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)F 62a_200025704644_100011998705 [1,1,0,0,0,0|2,0,0]=4 541 B14R2.2332 [13CH3]Sc1ccc2cc(ccc2n1)O 62a_200025704644_100009849208 [1,1,0,0,0,0|2,0,0]=4 542 B14R2.95 CCC(=O)C1=CCc2c1cccc2 1458a_100000037392_100000210202 [0,1,0,0,1,0|1,0,1]=4 543 B14R2.95 CCC(=O)C1C=Cc2c1cccc2 1458a_200009832160_100000210202 [0,1,0,0,1,0|1,0,1]=4 544 B14R2.95 CNC(=O)C1=CCc2c1cccc2 11a_106832991635_100000037392 [0,1,0,0,1,0|1,0,1]=4 545 B14R2.95 CNC(=O)C1=CCc2c1cccc2 1626a_100102657272_100000037392 [0,1,0,0,1,0|1,0,1]=4 546 B14R2.95 CNC(=O)C1=CCc2c1cccc2 240690a_100102657272_100000037392 [0,1,0,0,1,0|1,0,1]=4 547 B14R2.95 CNC(=O)C1C=Cc2c1cccc2 1626a_100102657272_200009832160 [0,1,0,0,1,0|1,0,1]=4 548 B14R2.95 CNC(=O)C1C=Cc2c1cccc2 240690a_100102657272_200009832160 [0,1,0,0,1,0|1,0,1]=4 549 B14R2.95 CNC(=O)C1C=Cc2c1cccc2 527a_100102657272_200009832160 [0,1,0,0,1,0|1,0,1]=4 550 B14R2.95 O=C(CF)C1=CCc2c1cccc2 1458a_100000037392_100015361967 [0,1,0,0,1,0|1,0,1]=4 551 B14R2.95 O=C(CF)C1C=Cc2c1cccc2 1458a_200009832160_100015361967 [0,1,0,0,1,0|1,0,1]=4 552 B14R2.300 CC(=O)n1ccc2c1ccc(c2)O 271570a_203496583355_100009995693 [0,1,0,0,1,0|2,0,0]=4 553 B14R2.5816 CC(=O)c1c[nH]c2c1cc(cc2)O 271570a_203496583355_100000731263 [0,1,0,0,1,0|2,0,0]=4 554 B14R2.5816 CC(=O)c1csc2c1cc(cc2)O 271570a_203496583355_100010167055 [0,1,0,0,1,0|2,0,0]=4 555 B14R2.8032 CC(=O)c1c[nH]c2c1cccc2O 271570a_203496583355_100010272396 [0,1,0,0,1,0|2,0,0]=4 556 B14R2.25733 CC(=O)n1cc(c2c1cccc2)O 271570a_203496583355_100010365038 [0,1,0,0,1,0|2,0,0]=4 557 B14R2.450 CC(=O)C1=C(c2ccccc2C1)C 1458a_200000242466_200000210301 [0,1,0,0,1,0|2,0,0]=4 558 B14R2.450 CC1=C(Cc2c1cccc2)C(=O)[13CH3] 1458a_200000242466_200025704644 [0,1,0,0,1,0|2,0,0]=4 559 B14R2.972 CCC(=O)C1=Cc2ccccc2C1 1458a_100009862756_100000210202 [0,1,0,0,1,0|2,0,0]=4 560 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 11a_106832991635_100009862756 [0,1,0,0,1,0|2,0,0]=4 561 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 1626a_100102657272_100009862756 [0,1,0,0,1,0|2,0,0]=4 562 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 240690a_100102657272_100009862756 [0,1,0,0,1,0|2,0,0]=4 563 B14R2.972 O=C(CF)C1=Cc2ccccc2C1 1458a_100009862756_100015361967 [0,1,0,0,1,0|2,0,0]=4 564 B14R2.4529 CC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000181247 [0,1,0,0,1,0|2,0,0]=4 565 B14R2.4529 CC(=O)c1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011795181 [0,1,0,0,1,0|2,0,0]=4 566 B14R2.4529 CC(=O)n1cc2cc(ccc2n1)O 271570a_203496583355_100010240164 [0,1,0,0,1,0|2,0,0]=4 567 B14R2.4529 CC(=O)n1cc2ccc(cc2n1)O 271570a_203496583355_100010184422 [0,1,0,0,1,0|2,0,0]=4 568 B14R2.4529 NC(=O)c1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009814496 [0,1,0,0,1,0|1,0,1]=4 569 B14R2.4529 NC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000185017 [0,1,0,0,1,0|2,0,0]=4 570 B14R2.4529 NC(=O)c1cc2ccc(cc2[nH]1)O 271570a_203496583355_100009814495 [0,1,0,0,1,0|1,0,1]=4 571 B14R2.7969 CC(=O)c1cc2cccc(c2o1)O 271570a_203496583355_100011280056 [0,1,0,0,1,0|2,0,0]=4 572 B14R2.7969 NC(=O)c1cc2cccc(c2s1)O 271570a_203496583355_100020879177 [0,1,0,0,1,0|2,0,0]=4 573 B16R2.1213 CCC(=O)C1=Cc2ccccc2OC=C1 1458a_200000089061_100000210202 [0,1,0,0,0,1|2,0,0]=4 574 B16R2.1213 CNC(=O)C1=Cc2ccccc2OC=C1 11a_106832991635_200000089061 [0,1,0,0,0,1|2,0,0]=4 575 B16R2.1213 CNC(=O)C1=Cc2ccccc2OC=C1 1626a_100102657272_200000089061 [0,1,0,0,0,1|2,0,0]=4 576 B16R2.1213 CNC(=O)C1=Cc2ccccc2OC=C1 240690a_100102657272_200000089061 [0,1,0,0,0,1|2,0,0]=4 577 B16R2.1213 O=C(CF)C1=Cc2ccccc2OC=C1 1458a_200000089061_100015361967 [0,1,0,0,0,1|2,0,0]=4 578 B16R2.3989 CC(=Cc1nc2ccccc2cc1Br)C 271570a_100102525489_100010072790 [0,1,0,0,0,1|2,0,0]=4 579 B16R2.3989 CC(=Cc1nc2ccccc2cc1C)C 271570a_100102525489_100000751756 [0,1,0,0,0,1|2,0,0]=4 580 B16R2.3989 CC(=Cc1nc2ccccc2cc1O)C 271570a_100102525489_200000100762 [0,1,0,0,0,1|2,0,0]=4 581 B16R2.3989 CC(=O)Cc1nc2ccccc2[nH]c1=O 1458a_100000070787_100000736137 [0,1,0,0,0,1|2,0,0]=4 582 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1Br 11a_100009991566_100015343762 [0,1,0,0,0,1|2,0,0]=4 583 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1Br 1626a_100009991566_100015343762 [0,1,0,0,0,1|2,0,0]=4 584 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1I 11a_100009892810_100015343762 [0,1,0,0,0,1|2,0,0]=4 585 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1I 1626a_100009892810_100015343762 [0,1,0,0,0,1|2,0,0]=4 586 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1O 22a_106744474703_100000070787 [0,1,0,0,0,1|2,0,0]=4 587 B16R2.3989 CC(=O)Nc1cc2ccccc2cc1O 527a_106744474703_100103153847 [0,1,0,0,0,1|2,0,0]=4 588 B16R2.5347 C#CC(=O)Cc1ccc2ccccc2c1 1458a_100000211873_100011216711 [0,1,0,0,0,1|2,0,0]=4 589 B16R2.5347 C#CC(=O)Cc1ccc2ccccc2n1 1458a_100000211873_100000737579 [0,1,0,0,0,1|1,0,0]=3 590 B16R2.5347 C#CC(=O)Cc1cnc2ccccc2n1 1458a_100000211873_200000751123 [0,1,0,0,0,1|2,0,0]=4 591 B16R2.5347 C#CC(=O)Cc1ncc2ccccc2n1 1458a_100000211873_100009868571 [0,1,0,0,0,1|2,0,0]=4 592 B16R2.5347 C=CC(=O)Cc1ccc2ccccc2c1 1458a_100000185746_100011216711 [0,1,0,0,0,1|2,0,0]=4 593 B16R2.5347 C=CC(=O)Cc1ccc2ccccc2n1 1458a_100000185746_100000737579 [0,1,0,0,0,1|1,0,0]=3 594 B16R2.5347 C=CC(=O)Cc1cnc2ccccc2n1 1458a_100000185746_200000751123 [0,1,0,0,0,1|2,0,0]=4 595 B16R2.5347 C=CC(=O)Cc1ncc2ccccc2n1 1458a_100000185746_100009868571 [0,1,0,0,0,1|2,0,0]=4 596 B16R2.5347 C=CC(=O)Nc1ccc2ccccc2c1 1626a_100000211940_100000185746 [0,1,0,0,0,1|2,0,0]=4 597 B16R2.5347 C=CC(=O)Nc1ccc2ccccc2c1 22a_100000211940_100000185746 [0,1,0,0,0,1|2,0,0]=4 598 B16R2.5347 CC(CO)Sc1ccc2ccccc2n1 62a_100012180447_100011291633 [0,1,0,0,0,1|1,0,1]=4 599 B16R2.5347 CCC(=O)Cc1ccc2ccccc2c1 1458a_100000181716_100000210202 [0,1,0,0,0,1|2,0,0]=4 600 B16R2.5347 CCC(=O)Cc1ccc2ccccc2c1 1458a_100000210414_100011216711 [0,1,0,0,0,1|2,0,0]=4 601 B16R2.5347 CCC(=O)Cc1ccc2ccccc2n1 1458a_100000210414_100000737579 [0,1,0,0,0,1|1,0,0]=3 602 B16R2.5347 CCC(=O)Cc1cnc2ccccc2n1 1458a_100000210414_200000751123 [0,1,0,0,0,1|2,0,0]=4 603 B16R2.5347 CCC(=O)Cc1ncc2ccccc2n1 1458a_100000210414_100009868571 [0,1,0,0,0,1|2,0,0]=4 604 B16R2.5347 CCC(=O)Nc1ccc2ccccc2c1 11a_100000211940_100000210414 [0,1,0,0,0,1|2,0,0]=4 605 B16R2.5347 CCC(=O)Nc1ccc2ccccc2c1 1626a_100000211940_100000210414 [0,1,0,0,0,1|2,0,0]=4 606 B16R2.5347 CCC(=O)Nc1ccc2ccccc2c1 22a_100000211940_100000210414 [0,1,0,0,0,1|2,0,0]=4 607 B16R2.5347 CCC(=O)Nc1ccc2ccccc2c1 527a_100000211940_100000210414 [0,1,0,0,0,1|2,0,0]=4 608 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 11a_106832991635_100000181716 [0,1,0,0,0,1|2,0,0]=4 609 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 1626a_100102657272_100000181716 [0,1,0,0,0,1|2,0,0]=4 610 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 240690a_100102657272_100000181716 [0,1,0,0,0,1|2,0,0]=4 611 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 527a_100102657272_100000181716 [0,1,0,0,0,1|2,0,0]=4 612 B16R2.5347 CNC(=O)Nc1ccc2ccccc2c1 2430a_100000211940_100102657272 [0,1,0,0,0,1|2,0,0]=4 613 B16R2.5347 COC(C)Sc1ccc2ccccc2n1 62a_100009879195_100011291633 [0,1,0,0,0,1|1,0,1]=4 614 B16R2.5347 COC(C)Sc1ccc2ccccc2n1 62a_100011291633_100009879195 [0,1,0,0,0,1|1,0,1]=4 615 B16R2.5347 C[C@H](CO)Nc1ccc2ccccc2n1 27a_100000737577_100011291633 [0,1,0,0,0,1|1,0,1]=4 616 B16R2.5347 C[C@H](CO)Sc1ccc2ccccc2n1 62a_100011291633_100016084084 [0,1,0,0,0,1|1,0,1]=4 617 B16R2.5347 C[C@H](CO)Sc1ccc2ccccc2n1 62a_100016084084_100011291633 [0,1,0,0,0,1|1,0,1]=4 618 B16R2.5347 O=C(CF)Cc1ccc2ccccc2c1 1458a_100000181716_100015361967 [0,1,0,0,0,1|2,0,0]=4 619 B16R2.5347 O=C(CO)Cc1cc2ccccc2cn1 1458a_100000210174_100009869231 [0,1,0,0,0,1|2,0,0]=4 620 B16R2.5347 O=C(CO)Cc1ccc2ccccc2c1 1458a_100000210174_100011216711 [0,1,0,0,0,1|1,0,0]=3 621 B16R2.5347 O=C(CO)Cc1ccc2ccccc2n1 1458a_100000210174_100000737579 [0,1,0,0,0,1|0,0,0]=2 622 B16R2.5347 O=C(CO)Cc1ccc2cnccc2c1 1458a_100000210174_100020605334 [0,1,0,0,0,1|2,0,0]=4 623 B16R2.5347 O=C(CO)Cc1ccc2ncccc2c1 1458a_100000210174_100000703657 [0,1,0,0,0,1|2,0,0]=4 624 B16R2.5347 O=C(CO)Cc1cnc2ccccc2n1 1458a_100000210174_200000751123 [0,1,0,0,0,1|1,0,0]=3 625 B16R2.5347 O=C(CO)Cc1ncc2ccccc2n1 1458a_100000210174_100009868571 [0,1,0,0,0,1|1,0,0]=3 626 B16R2.5347 O=C(CO)Nc1ccc2ccccc2c1 22a_100000211940_100000210174 [0,1,0,0,0,1|1,0,0]=3 627 B16R2.5347 O=C(CO)Nc1ccc2ccccc2c1 527a_100000211940_100000210174 [0,1,0,0,0,1|1,0,0]=3 628 B16R2.5347 O=C(CO)Nc1ccc2cccnc2c1 22a_100102887122_100000210174 [0,1,0,0,0,1|2,0,0]=4 629 B16R2.5347 O=C(CO)Nc1ccc2cccnc2c1 527a_100102887122_100000210174 [0,1,0,0,0,1|2,0,0]=4 630 B16R2.5347 O=C(CO)Nc1ccc2ccncc2c1 22a_100000069342_100000210174 [0,1,0,0,0,1|2,0,0]=4 631 B16R2.5347 O=C(CO)Nc1ccc2ccncc2c1 527a_100000069342_100000210174 [0,1,0,0,0,1|2,0,0]=4 632 B16R2.5347 O=C(CO)Nc1ccc2cnccc2c1 22a_100000039641_100000210174 [0,1,0,0,0,1|2,0,0]=4 633 B16R2.5347 O=C(CO)Nc1ccc2cnccc2c1 527a_100000039641_100000210174 [0,1,0,0,0,1|2,0,0]=4 634 B16R2.5347 O=C(CO)Nc1ccc2ncccc2c1 22a_100011198106_100000210174 [0,1,0,0,0,1|2,0,0]=4 635 B16R2.5347 O=C(CO)Nc1ccc2ncccc2c1 527a_100011198106_100000210174 [0,1,0,0,0,1|2,0,0]=4 636 B16R2.6284 CC(=C(C)c1ccc2ccccc2n1)C 271570a_200000049429_100011291633 [0,1,0,0,0,1|2,0,0]=4 637 B16R2.6284 CC(=O)N(C)c1ccc2ccccc2c1 11a_100000181211_100015343762 [0,1,0,0,0,1|2,0,0]=4 638 B16R2.6284 CC(=O)N(C)c1ccc2ccccc2c1 1626a_100000181211_100015343762 [0,1,0,0,0,1|2,0,0]=4 639 B16R2.6284 CC(=O)N(C)c1ccc2ccccc2c1 22a_100000181211_100000070787 [0,1,0,0,0,1|2,0,0]=4 640 B16R2.6284 CC(=O)N(C)c1ccc2ccccc2c1 527a_100000181211_100103153847 [0,1,0,0,0,1|2,0,0]=4 641 B16R2.11975 CC(=Cc1ccc2ccc(cc2n1)O)C 271570a_100102525489_100000079174 [0,1,0,0,0,1|2,0,0]=4 642 B16R2.11975 CC(=O)Cc1ccc2ccc(cc2n1)Cl 1458a_100000070787_100010196396 [0,1,0,0,0,1|1,0,0]=3 643 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)Br 11a_100010090036_100015343762 [0,1,0,0,0,1|2,0,0]=4 644 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)Br 1626a_100010090036_100015343762 [0,1,0,0,0,1|2,0,0]=4 645 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)Br 22a_100010090036_100000070787 [0,1,0,0,0,1|2,0,0]=4 646 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)Br 527a_100010090036_100103153847 [0,1,0,0,0,1|2,0,0]=4 647 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)O 1626a_100015378740_100015343762 [0,1,0,0,0,1|2,0,0]=4 648 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)O 22a_100015378740_100000070787 [0,1,0,0,0,1|2,0,0]=4 649 B16R2.11975 CC(=O)Nc1ccc2ccc(cc2c1)O 527a_100015378740_100103153847 [0,1,0,0,0,1|2,0,0]=4 650 B16R2.11988 CC(=Cc1ccc2cc(ccc2n1)C)C 271570a_100102525489_100011865911 [0,1,0,0,0,1|2,0,0]=4 651 B16R2.11988 CC(=Cc1ccc2cc(ccc2n1)F)C 271570a_100102525489_100011998705 [0,1,0,0,0,1|2,0,0]=4 652 B16R2.11988 CC(=Cc1ccc2cc(ccc2n1)O)C 271570a_100102525489_100009849208 [0,1,0,0,0,1|2,0,0]=4 653 B16R2.11988 CC(=O)Cc1ccc2cc(ccc2c1)Br 1458a_100000070787_100012356510 [0,1,0,0,0,1|2,0,0]=4 654 B16R2.11988 CC(=O)Cc1ccc2cc(ccc2n1)C 1458a_100000070787_100009884411 [0,1,0,0,0,1|1,0,0]=3 655 B16R2.11988 CC(=O)Nc1ccc2cc(ccc2c1)Br 11a_100000185457_100015343762 [0,1,0,0,0,1|2,0,0]=4 656 B16R2.11988 CC(=O)Nc1ccc2cc(ccc2c1)Br 1626a_100000185457_100015343762 [0,1,0,0,0,1|2,0,0]=4 657 B16R2.11988 CC(=O)Nc1ccc2cc(ccc2c1)Br 22a_100000185457_100000070787 [0,1,0,0,0,1|2,0,0]=4 658 B16R2.11988 CC(=O)Nc1ccc2cc(ccc2c1)Br 527a_100000185457_100103153847 [0,1,0,0,0,1|2,0,0]=4 659 B16R2.22859 CC(=O)Nc1ccc2c(cccc2c1)O 1626a_100000035793_100015343762 [0,1,0,0,0,1|2,0,0]=4 660 B16R2.22859 CC(=O)Nc1ccc2c(cccc2c1)O 22a_100000035793_100000070787 [0,1,0,0,0,1|2,0,0]=4 661 B16R2.22859 CC(=O)Nc1ccc2c(cccc2c1)O 527a_100000035793_100103153847 [0,1,0,0,0,1|2,0,0]=4 662 B16R2.24933 CC(=Cc1cc(c2ccccc2n1)C)C 271570a_100102525489_100012354972 [0,1,0,0,0,1|2,0,0]=4 663 B16R2.24933 CC(=Cc1cc(c2ccccc2n1)N)C 271570a_100102525489_100010197925 [0,1,0,0,0,1|2,0,0]=4 664 B16R2.24933 CC(=O)Cc1cc(=O)n2ccccc2n1 1458a_100000070787_100000017730 [0,1,0,0,0,1|2,0,0]=4 665 B16R2.24933 CC(=O)Cc1nc(c2ccccc2n1)C 1458a_100000070787_100000736427 [0,1,0,0,0,1|2,0,0]=4 666 B16R2.24933 CC(=O)Cc1nc(c2ccccc2n1)Cl 1458a_100000070787_100010180038 [0,1,0,0,0,1|2,0,0]=4 667 B16R2.24933 CC(=O)Cc1nc2ccccc2c(=O)[nH]1 1458a_100000070787_100000182789 [0,1,0,0,0,1|2,0,0]=4 668 B16R2.24933 CC(=O)Nc1cc(c2ccccc2c1)Br 11a_100010089974_100015343762 [0,1,0,0,0,1|2,0,0]=4 669 B16R2.24933 CC(=O)Nc1cc(c2ccccc2c1)Br 1626a_100010089974_100015343762 [0,1,0,0,0,1|2,0,0]=4 670 B16R2.24933 CC(=O)Nc1cc(c2ccccc2c1)Br 22a_100010089974_100000070787 [0,1,0,0,0,1|2,0,0]=4 671 B16R2.24933 CC(=O)Nc1cc(c2ccccc2c1)Br 527a_100010089974_100103153847 [0,1,0,0,0,1|2,0,0]=4 672 B16R2.83538 CC(=O)Cc1ccc2ccccc2c1Br 1458a_100000070787_100009813938 [0,1,0,0,0,1|2,0,0]=4 673 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1Br 11a_100000705303_100015343762 [0,1,0,0,0,1|2,0,0]=4 674 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1Br 1626a_100000705303_100015343762 [0,1,0,0,0,1|2,0,0]=4 675 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1Cl 11a_100000075557_100015343762 [0,1,0,0,0,1|2,0,0]=4 676 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1Cl 1626a_100000075557_100015343762 [0,1,0,0,0,1|2,0,0]=4 677 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1O 22a_100000007060_100000070787 [0,1,0,0,0,1|2,0,0]=4 678 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1O 271570a_203496583355_200009892723 [0,1,0,0,0,1|2,0,0]=4 679 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1O 527a_100000007060_100103153847 [0,1,0,0,0,1|2,0,0]=4 680 B16R2.83538 CC(=O)Oc1ccc2ccccc2c1O 271570a_203496583355_200103289829 [0,1,0,0,0,1|2,0,0]=4 681 B16R2.126902 CC(=Cc1ccc2cccc(c2n1)C)C 271570a_100102525489_100012002297 [0,1,0,0,0,1|2,0,0]=4 682 B16R2.126902 CC(=Cc1ccc2cccc(c2n1)F)C 271570a_100102525489_100012017632 [0,1,0,0,0,1|2,0,0]=4 683 B16R2.126902 CC(=Cc1ccc2cccc(c2n1)O)C 271570a_100102525489_100010153751 [0,1,0,0,0,1|2,0,0]=4 684 B16R2.126902 CC(=O)Nc1ccc2cccc(c2c1)O 1626a_100132313934_100015343762 [0,1,0,0,0,1|2,0,0]=4 685 B16R2.126902 CC(=O)Nc1ccc2cccc(c2c1)O 22a_100132313934_100000070787 [0,1,0,0,0,1|2,0,0]=4 686 B16R2.126902 CC(=O)Nc1ccc2cccc(c2c1)O 527a_100132313934_100103153847 [0,1,0,0,0,1|2,0,0]=4 687 B16R2.1229 CCC(=O)c1ccc2ccccc2c1Br 1458a_100000239384_100000210202 [0,2,0,0,0,0|2,0,0]=4 688 B16R2.1229 CCC(=O)c1ccc2ccccc2c1O 1458a_100000181341_100000210202 [0,2,0,0,0,0|2,0,0]=4 689 B16R2.1229 CNC(=O)c1ccc2ccccc2c1Br 11a_106832991635_100000239384 [0,2,0,0,0,0|2,0,0]=4 690 B16R2.1229 CNC(=O)c1ccc2ccccc2c1Br 1626a_100102657272_100000239384 [0,2,0,0,0,0|2,0,0]=4 691 B16R2.1229 CNC(=O)c1ccc2ccccc2c1Br 240690a_100102657272_100000239384 [0,2,0,0,0,0|2,0,0]=4 692 B16R2.1229 CNC(=O)c1ccc2ccccc2c1Br 527a_100102657272_100000239384 [0,2,0,0,0,0|2,0,0]=4 693 B16R2.1229 CNC(=O)c1ccc2ccccc2c1O 240690a_100102657272_100000181341 [0,2,0,0,0,0|2,0,0]=4 694 B16R2.1229 CNC(=O)c1ccc2ccccc2c1O 527a_100102657272_100000181341 [0,2,0,0,0,0|2,0,0]=4 695 B16R2.1229 COC(=O)c1ccc2ccccc2c1O 271570a_203496583355_100102564387 [0,2,0,0,0,0|1,0,0]=3 696 B16R2.1229 O=C(CF)c1ccc2ccccc2c1Br 1458a_100000239384_100015361967 [0,2,0,0,0,0|2,0,0]=4 697 B16R2.1229 O=C(CF)c1ccc2ccccc2c1O 1458a_100000181341_100015361967 [0,2,0,0,0,0|2,0,0]=4 698 B16R2.6148 C=Cc1c(ccc2c1cccc2)C(=O)N 271570a_100011290941_100011091912 [0,2,0,0,0,0|2,0,0]=4 699 B16R2.6148 CNc1c(ccc2c1cccc2)C(=O)N 27a_100102657272_100011091912 [0,2,0,0,0,0|2,0,0]=4 700 B16R2.6148 COc1c(ccc2c1cccc2)C(=O)C 1458a_100000230751_200000210301 [0,2,0,0,0,0|2,0,0]=4 701 B16R2.6148 COc1c(ccc2c1cccc2)C(=O)[13CH3] 1458a_100000230751_200025704644 [0,2,0,0,0,0|2,0,0]=4 702 B16R2.6148 CSc1c(ccc2c1cccc2)C(=O)N 62a_100011091912_200000210301 [0,2,0,0,0,0|2,0,0]=4 703 B16R2.6148 [13CH3]Sc1c(ccc2c1cccc2)C(=O)N 62a_100011091912_200025704644 [0,2,0,0,0,0|2,0,0]=4 704 B16R2.23331 CC(=O)c1cc(c2ccccc2c1O)O 1458a_100000212128_200000210301 [0,2,0,0,0,0|2,0,0]=4 705 B16R2.23331 [13CH3]C(=O)c1cc(c2ccccc2c1O)O 1458a_100000212128_200025704644 [0,2,0,0,0,0|2,0,0]=4 706 B16R2.23372 CC(=O)c1c(cc2ccccc2c1O)O 1458a_100009996417_200000210301 [0,2,0,0,0,0|2,0,0]=4 707 B16R2.23372 [13CH3]C(=O)c1c(cc2ccccc2c1O)O 1458a_100009996417_200025704644 [0,2,0,0,0,0|2,0,0]=4 708 B16R2.1612 C=C(C)c1nc2ccccc2cc1C#N 271570a_100000694244_100015207123 [0,2,0,0,0,0|2,0,0]=4 709 B16R2.1612 C=C(C)c1nc2ccccc2cc1C=O 271570a_100000694244_100000183649 [0,2,0,0,0,0|2,0,0]=4 710 B16R2.1612 C=C(C)c1nc2ccccc2cc1CC 271570a_100000694244_100011829826 [0,2,0,0,0,0|2,0,0]=4 711 B16R2.1612 C=C(C)c1nc2ccccc2cc1CO 271570a_100000694244_100000754719 [0,2,0,0,0,0|2,0,0]=4 712 B16R2.1612 COc1cc2ccccc2cc1C(=O)C 1458a_100000185179_200000210301 [0,2,0,0,0,0|2,0,0]=4 713 B16R2.1612 COc1cc2ccccc2cc1C(=O)N 34a_200000192805_200000210301 [0,2,0,0,0,0|2,0,0]=4 714 B16R2.1612 COc1cc2ccccc2cc1C(=O)N 7a_200000192805_200000210301 [0,2,0,0,0,0|2,0,0]=4 715 B16R2.1612 COc1cc2ccccc2cc1C(=O)[13CH3] 1458a_100000185179_200025704644 [0,2,0,0,0,0|2,0,0]=4 716 B16R2.1612 [13CH3]Oc1cc2ccccc2cc1C(=O)N 34a_200000192805_200025704644 [0,2,0,0,0,0|2,0,0]=4 717 B16R2.1612 [13CH3]Oc1cc2ccccc2cc1C(=O)N 7a_200000192805_200025704644 [0,2,0,0,0,0|2,0,0]=4 718 B16R2.23521 CC(=O)c1cc2cc(ccc2cc1O)Br 1458a_100009814095_200000210301 [0,2,0,0,0,0|2,0,0]=4 719 B16R2.23521 [13CH3]C(=O)c1cc2cc(ccc2cc1O)Br 1458a_100009814095_200025704644 [0,2,0,0,0,0|2,0,0]=4 720 B16R2.33941 CCC(=O)c1cc2ccccc2cc1Cl 1458a_100010003416_100000210202 [0,2,0,0,0,0|2,0,0]=4 721 B16R2.33941 CCC(=O)c1cc2ccccc2cc1O 1458a_100000212107_100000210202 [0,2,0,0,0,0|2,0,0]=4 722 B16R2.33941 CNC(=O)c1cc2ccccc2cc1Cl 11a_106832991635_100010003416 [0,2,0,0,0,0|2,0,0]=4 723 B16R2.33941 CNC(=O)c1cc2ccccc2cc1Cl 1626a_100102657272_100010003416 [0,2,0,0,0,0|2,0,0]=4 724 B16R2.33941 CNC(=O)c1cc2ccccc2cc1Cl 240690a_100102657272_100010003416 [0,2,0,0,0,0|2,0,0]=4 725 B16R2.33941 CNC(=O)c1cc2ccccc2cc1Cl 527a_100102657272_100010003416 [0,2,0,0,0,0|2,0,0]=4 726 B16R2.33941 CNC(=O)c1cc2ccccc2cc1O 11a_106832991635_100000212107 [0,2,0,0,0,0|2,0,0]=4 727 B16R2.33941 CNC(=O)c1cc2ccccc2cc1O 1626a_100102657272_100000212107 [0,2,0,0,0,0|2,0,0]=4 728 B16R2.33941 CNC(=O)c1cc2ccccc2cc1O 240690a_100102657272_100000212107 [0,2,0,0,0,0|2,0,0]=4 729 B16R2.33941 CNC(=O)c1cc2ccccc2cc1O 527a_100102657272_100000212107 [0,2,0,0,0,0|2,0,0]=4 730 B16R2.33941 COC(=O)c1cc2ccccc2nc1O 271570a_203496583355_100000071358 [0,2,0,0,0,0|2,0,0]=4 731 B16R2.33941 O=C(CF)c1cc2ccccc2cc1Cl 1458a_100010003416_100015361967 [0,2,0,0,0,0|2,0,0]=4 732 B16R2.33941 O=C(CF)c1cc2ccccc2cc1O 1458a_100000212107_100015361967 [0,2,0,0,0,0|2,0,0]=4 733 B16R2.83668 CC(=O)c1cc2ccccc2c(c1O)Br 1458a_100011255223_200000210301 [0,2,0,0,0,0|2,0,0]=4 734 B16R2.83668 [13CH3]C(=O)c1cc2ccccc2c(c1O)Br 1458a_100011255223_200025704644 [0,2,0,0,0,0|2,0,0]=4 735 B16R2.126889 CC(=O)c1cc2cccc(c2cc1O)O 1458a_200000029084_200000210301 [0,2,0,0,0,0|2,0,0]=4 736 B16R2.126889 [13CH3]C(=O)c1cc2cccc(c2cc1O)O 1458a_200000029084_200025704644 [0,2,0,0,0,0|2,0,0]=4 737 B16R2.767 C#CCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100000184674 [0,2,0,0,0,0|2,0,0]=4 738 B16R2.767 C=CCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100000210623 [0,2,0,0,0,0|2,0,0]=4 739 B16R2.767 CCCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100000210303 [0,2,0,0,0,0|2,0,0]=4 740 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 11a_100015525214_100000210637 [0,2,0,0,0,0|2,0,0]=4 741 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 240690a_100015525214_100000210637 [0,2,0,0,0,0|2,0,0]=4 742 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 527a_100015525214_100000210637 [0,2,0,0,0,0|2,0,0]=4 743 B16R2.767 CN(CCO)c1ccc2ccccc2n1 27a_100000210263_100011291633 [0,2,0,0,0,0|2,0,0]=4 744 B16R2.767 CNCC(=O)c1ccc2ccccc2c1 2230a_106832991635_100000211431 [0,2,0,0,0,0|2,0,0]=4 745 B16R2.767 CNCC(=O)c1ccc2ccccc2c1 7a_106832991635_100000211431 [0,2,0,0,0,0|2,0,0]=4 746 B16R2.767 CNNC(=O)c1ccc2ccccc2c1 22a_100016993582_100000210637 [0,2,0,0,0,0|2,0,0]=4 747 B16R2.767 CSCC(=O)c1ccc2ccccc2c1 62a_100000211431_200000210301 [0,2,0,0,0,0|1,1,0]=4 748 B16R2.767 CSCC(=O)c1ccc2ccccc2c1 62a_200000210301_100000211431 [0,2,0,0,0,0|1,1,0]=4 749 B16R2.767 N#CCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100011214920 [0,2,0,0,0,0|2,0,0]=4 750 B16R2.767 O=C(CCF)c1ccc2ccccc2c1 1458a_100000210637_100011217306 [0,2,0,0,0,0|2,0,0]=4 751 B16R2.767 O=C(CCO)c1ccc2ccccc2c1 1458a_100000210637_100000211926 [0,2,0,0,0,0|1,0,0]=3 752 B16R2.767 O=C(CCO)c1ccc2cccnc2c1 1458a_100011933907_100000211926 [0,2,0,0,0,0|2,0,0]=4 753 B16R2.767 O=C(CCO)c1ccc2ccncc2c1 1458a_100000070124_100000211926 [0,2,0,0,0,0|2,0,0]=4 754 B16R2.767 O=C(CCO)c1ccc2cnccc2c1 1458a_100011935275_100000211926 [0,2,0,0,0,0|2,0,0]=4 755 B16R2.767 O=C(CCO)c1ccc2ncccc2c1 1458a_100011216044_100000211926 [0,2,0,0,0,0|2,0,0]=4 756 B16R2.767 [13CH3]SCC(=O)c1ccc2ccccc2c1 62a_100000211431_200025704644 [0,2,0,0,0,0|1,1,0]=4 757 B16R2.767 [13CH3]SCC(=O)c1ccc2ccccc2c1 62a_200025704644_100000211431 [0,2,0,0,0,0|1,1,0]=4 758 B16R2.1205 CCC(=O)c1ccc2ccc(cc2c1)Br 1458a_200010152650_100000210202 [0,2,0,0,0,0|2,0,0]=4 759 B16R2.1205 CNC(=O)c1ccc2ccc(cc2c1)Br 11a_106832991635_200010152650 [0,2,0,0,0,0|2,0,0]=4 760 B16R2.1205 CNC(=O)c1ccc2ccc(cc2c1)Br 1626a_100102657272_200010152650 [0,2,0,0,0,0|2,0,0]=4 761 B16R2.1205 CNC(=O)c1ccc2ccc(cc2c1)Br 240690a_100102657272_200010152650 [0,2,0,0,0,0|2,0,0]=4 762 B16R2.1205 CNC(=O)c1ccc2ccc(cc2c1)Br 527a_100102657272_200010152650 [0,2,0,0,0,0|2,0,0]=4 763 B16R2.1205 CNC(=O)c1ccc2ccc(cc2c1)O 240690a_100102657272_100009860967 [0,2,0,0,0,0|2,0,0]=4 764 B16R2.1205 COC(=O)c1ccc2ccc(cc2n1)O 271570a_203496583355_200010096807 [0,2,0,0,0,0|0,0,0]=2 765 B16R2.1205 COC(=O)c1ccc2ccc(nc2c1)O 271570a_203496583355_100010382898 [0,2,0,0,0,0|2,0,0]=4 766 B16R2.1205 COC(=O)c1ccc2ncc(cc2c1)O 271570a_203496583355_100010124980 [0,2,0,0,0,0|2,0,0]=4 767 B16R2.1205 O=C(CF)c1ccc2ccc(cc2c1)Br 1458a_200010152650_100015361967 [0,2,0,0,0,0|2,0,0]=4 768 B16R2.1212 COC(=O)c1ccc2cccc(c2n1)O 271570a_203496583355_100012345875 [0,2,0,0,0,0|0,0,0]=2 769 B16R2.1212 COC(=O)c1ccc2nccc(c2c1)O 271570a_203496583355_100010168892 [0,2,0,0,0,0|2,0,0]=4 770 B16R2.33799 CCC(=O)c1ccc2cc(ccc2c1)Br 1458a_100000759775_100000210202 [0,2,0,0,0,0|2,0,0]=4 771 B16R2.33799 CCC(=O)c1ccc2cc(ccc2c1)Cl 1458a_200010245464_100000210202 [0,2,0,0,0,0|2,0,0]=4 772 B16R2.33799 CCC(=O)c1ccc2cc(ccc2c1)F 1458a_200000042716_100000210202 [0,2,0,0,0,0|2,0,0]=4 773 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Br 11a_106832991635_100000759775 [0,2,0,0,0,0|2,0,0]=4 774 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Br 1626a_100102657272_100000759775 [0,2,0,0,0,0|2,0,0]=4 775 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Br 240690a_100102657272_100000759775 [0,2,0,0,0,0|2,0,0]=4 776 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Br 527a_100102657272_100000759775 [0,2,0,0,0,0|2,0,0]=4 777 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Cl 11a_106832991635_200010245464 [0,2,0,0,0,0|2,0,0]=4 778 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Cl 1626a_100102657272_200010245464 [0,2,0,0,0,0|2,0,0]=4 779 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Cl 240690a_100102657272_200010245464 [0,2,0,0,0,0|2,0,0]=4 780 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)Cl 527a_100102657272_200010245464 [0,2,0,0,0,0|2,0,0]=4 781 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)F 11a_106832991635_200000042716 [0,2,0,0,0,0|2,0,0]=4 782 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)F 1626a_100102657272_200000042716 [0,2,0,0,0,0|2,0,0]=4 783 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)F 240690a_100102657272_200000042716 [0,2,0,0,0,0|2,0,0]=4 784 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)F 527a_100102657272_200000042716 [0,2,0,0,0,0|2,0,0]=4 785 B16R2.33799 CNC(=O)c1ccc2cc(ccc2c1)O 240690a_100102657272_100000234869 [0,2,0,0,0,0|2,0,0]=4 786 B16R2.33799 COC(=O)c1ccc2cc(ccc2c1)O 271570a_203496583355_100011218122 [0,2,0,0,0,0|1,0,0]=3 787 B16R2.33799 COC(=O)c1ccc2cc(ccc2n1)O 271570a_203496583355_100012354044 [0,2,0,0,0,0|0,0,0]=2 788 B16R2.33799 COC(=O)c1ccc2nc(ccc2c1)O 271570a_203496583355_100000047742 [0,2,0,0,0,0|2,0,0]=4 789 B16R2.33799 COC(=O)c1cnc2cc(ccc2c1)O 271570a_203496583355_100010209555 [0,2,0,0,0,0|2,0,0]=4 790 B16R2.33799 O=C(CF)c1ccc2cc(ccc2c1)Br 1458a_100000759775_100015361967 [0,2,0,0,0,0|2,0,0]=4 791 B16R2.33799 O=C(CF)c1ccc2cc(ccc2c1)Cl 1458a_200010245464_100015361967 [0,2,0,0,0,0|2,0,0]=4 792 B16R2.33799 O=C(CF)c1ccc2cc(ccc2c1)F 1458a_200000042716_100015361967 [0,2,0,0,0,0|2,0,0]=4 793 B16R2.173132 CCC(=O)c1ccc2c(cccc2c1)Br 1458a_100000691321_100000210202 [0,2,0,0,0,0|2,0,0]=4 794 B16R2.173132 CCC(=O)c1ccc2c(cccc2c1)Cl 1458a_100010089951_100000210202 [0,2,0,0,0,0|2,0,0]=4 795 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Br 11a_106832991635_100000691321 [0,2,0,0,0,0|2,0,0]=4 796 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Br 1626a_100102657272_100000691321 [0,2,0,0,0,0|2,0,0]=4 797 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Br 240690a_100102657272_100000691321 [0,2,0,0,0,0|2,0,0]=4 798 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Br 527a_100102657272_100000691321 [0,2,0,0,0,0|2,0,0]=4 799 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Cl 11a_106832991635_100010089951 [0,2,0,0,0,0|2,0,0]=4 800 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Cl 1626a_100102657272_100010089951 [0,2,0,0,0,0|2,0,0]=4 801 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Cl 240690a_100102657272_100010089951 [0,2,0,0,0,0|2,0,0]=4 802 B16R2.173132 CNC(=O)c1ccc2c(cccc2c1)Cl 527a_100102657272_100010089951 [0,2,0,0,0,0|2,0,0]=4 803 B16R2.173132 COC(=O)c1ccc2c(cccc2c1)O 271570a_203496583355_100010188500 [0,2,0,0,0,0|1,0,0]=3 804 B16R2.173132 COC(=O)c1ccc2c(cccc2n1)O 271570a_203496583355_100010275744 [0,2,0,0,0,0|0,0,0]=2 805 B16R2.173132 COC(=O)c1ccc2c(ccnc2c1)O 271570a_203496583355_100010143524 [0,2,0,0,0,0|2,0,0]=4 806 B16R2.173132 COC(=O)c1ccc2c(nccc2c1)O 271570a_203496583355_100010291108 [0,2,0,0,0,0|2,0,0]=4 807 B16R2.173132 COC(=O)c1cnc2c(cccc2c1)O 271570a_203496583355_100010124613 [0,2,0,0,0,0|2,0,0]=4 808 B16R2.173132 O=C(CF)c1ccc2c(cccc2c1)Br 1458a_100000691321_100015361967 [0,2,0,0,0,0|2,0,0]=4 809 B16R2.173132 O=C(CF)c1ccc2c(cccc2c1)Cl 1458a_100010089951_100015361967 [0,2,0,0,0,0|2,0,0]=4 810 B16R2.7476 C=C(C)c1ccc2ccc(cc2n1)OC 271570a_100000694244_100009877240 [0,2,0,0,0,0|2,0,0]=4 811 B16R2.133406 C=C(C)c1cc(c2ccc(cc2n1)N)C 271570a_100000694244_100000103534 [0,2,0,0,0,0|2,0,0]=4 812 B16R2.7486 C=C(C)c1ccc2cc(ccc2n1)C#N 271570a_100000694244_100000091635 [0,2,0,0,0,0|2,0,0]=4 813 B16R2.7486 C=C(C)c1ccc2cc(ccc2n1)C=O 271570a_100000694244_100000087602 [0,2,0,0,0,0|2,0,0]=4 814 B16R2.7486 C=C(C)c1ccc2cc(ccc2n1)OC 271570a_100000694244_100000743015 [0,2,0,0,0,0|2,0,0]=4 815 B16R2.7486 C=Cc1ccc2cc(ccc2c1)C(=O)C 271570a_100011290941_100012339427 [0,2,0,0,0,0|2,0,0]=4 816 B16R2.7486 CC(=O)c1ccc2cc(ccc2c1)O[13CH3] 34a_100000074906_200025704644 [0,2,0,0,0,0|2,0,0]=4 817 B16R2.7486 CC(=O)c1ccc2cc(ccc2c1)O[13CH3] 7a_100000074906_200025704644 [0,2,0,0,0,0|2,0,0]=4 818 B16R2.7486 CC(=O)c1ccc2cc(ccc2c1)S[13CH3] 62a_100012339427_200025704644 [0,2,0,0,0,0|2,0,0]=4 819 B16R2.7486 CC(=O)c1ccc2cc(ccc2c1)S[13CH3] 62a_200025704644_100012339427 [0,2,0,0,0,0|2,0,0]=4 820 B16R2.7486 COc1ccc2cc(ccc2c1)C(=O)C 1458a_100000189627_200000210301 [0,2,0,0,0,0|2,0,0]=4 821 B16R2.7486 COc1ccc2cc(ccc2c1)C(=O)C 34a_100000074906_200000210301 [0,2,0,0,0,0|2,0,0]=4 822 B16R2.7486 COc1ccc2cc(ccc2c1)C(=O)C 7a_100000074906_200000210301 [0,2,0,0,0,0|2,0,0]=4 823 B16R2.7486 COc1ccc2cc(ccc2c1)C(=O)[13CH3] 1458a_100000189627_200025704644 [0,2,0,0,0,0|2,0,0]=4 824 B16R2.7486 CSc1ccc2cc(ccc2c1)C(=O)C 62a_100012339427_200000210301 [0,2,0,0,0,0|2,0,0]=4 825 B16R2.7486 CSc1ccc2cc(ccc2c1)C(=O)C 62a_200000210301_100012339427 [0,2,0,0,0,0|2,0,0]=4 826 B16R2.23501 C=C(C)c1cc(c2cc(ccc2n1)F)C 271570a_100000694244_200000079853 [0,2,0,0,0,0|2,0,0]=4 827 B16R2.26112 C=C(C)c1ccc2cc(cc(c2n1)C)C 271570a_100000694244_200012017542 [0,2,0,0,0,0|2,0,0]=4 828 B16R2.36806 C=C(C)c1ccc2c(cccc2n1)OC 271570a_100000694244_100010382897 [0,2,0,0,0,0|2,0,0]=4 829 B16R2.22890 C=C(C)c1cc(c2cccc(c2n1)C)C 271570a_100000694244_100000008058 [0,2,0,0,0,0|2,0,0]=4 830 B16R2.40082 C=C(C)c1cc(c2ccccc2n1)OC 271570a_100000694244_200010892118 [0,2,0,0,0,0|2,0,0]=4 831 B16R2.189541 C=C(C)c1ccc2cccc(c2n1)OC 271570a_100000694244_200011787714 [0,2,0,0,0,0|2,0,0]=4 832 B14R2.1073 C=Cc1cccc2c1CCC(=O)O2 271570a_100011290941_200015620928 [0,0,1,1,0,0|1,0,1]=4 833 B14R2.1073 C=Cc1cccc2c1ccc(=O)[nH]2 271570a_100011290941_100000726145 [0,0,1,1,0,0|2,0,0]=4 834 B14R2.256 Cc1ccc(o1)c2ccccc2Br 271570a_100000061910_100000695589 [0,0,1,1,0,0|2,0,0]=4 835 B14R2.256 Cc1ccc(o1)c2ccccc2C 271570a_100000061910_100000210755 [0,0,1,1,0,0|2,0,0]=4 836 B14R2.256 Cc1ccc(o1)c2ccccc2Cl 271570a_100000061910_100000764095 [0,0,1,1,0,0|2,0,0]=4 837 B14R2.256 Cc1ccc(o1)c2ccccc2F 271570a_100000061910_100011215700 [0,0,1,1,0,0|2,0,0]=4 838 B14R2.256 Cc1ccc(o1)c2ccccc2N 271570a_100000061910_100000210017 [0,0,1,1,0,0|1,0,1]=4 839 B14R2.256 Cc1ccc(o1)c2ccccc2O 271570a_100000061910_100000739446 [0,0,1,1,0,0|2,0,0]=4 840 B14R2.31359 CC(=O)c1cccc2c1cccc2 1458a_100000210949_200000210301 [0,0,1,1,0,0|2,0,0]=4 841 B14R2.31359 [13CH3]C(=O)c1cccc2c1cccc2 1458a_100000210949_200025704644 [0,0,1,1,0,0|2,0,0]=4 842 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,0,1,0,1,0|1,0,1]=4 843 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [0,0,1,0,1,0|1,0,1]=4 844 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [0,0,1,0,1,0|1,0,1]=4 845 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [0,0,1,0,1,0|1,0,1]=4 846 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [0,0,1,0,1,0|1,0,1]=4 847 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [0,0,1,0,1,0|1,0,1]=4 848 B12R1.75 C=Cc1ccccc1NC(=O)N 271570a_100011290941_100000742221 [0,0,1,0,1,0|1,0,1]=4 849 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [0,0,1,0,1,0|2,0,0]=4 850 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [1,0,0,0,1,0|2,0,0]=4 851 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [1,0,0,0,1,0|2,0,0]=4 852 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [1,0,0,0,1,0|1,0,1]=4 853 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [1,0,0,0,1,0|2,0,0]=4 854 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [1,0,0,0,1,0|2,0,0]=4 855 B12R2.32 C=Cc1cn2ccccc2n1 271570a_100011290941_100009819586 [1,0,0,0,1,0|2,0,0]=4 856 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [1,0,0,0,1,0|2,0,0]=4 857 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [1,0,0,0,1,0|2,0,0]=4 858 B12R2.44 C=Cc1ccc2[nH]ccc2n1 271570a_100011290941_100000087148 [1,0,0,0,1,0|2,0,0]=4 859 B12R2.44 C=Cc1ccc2cc[nH]c2n1 271570a_100011290941_100009814870 [1,0,0,0,1,0|2,0,0]=4 860 B12R2.44 C=Cc1ccc2occc2n1 271570a_100011290941_100009851292 [1,0,0,0,1,0|2,0,0]=4 861 B12R2.44 C=Cc1ccc2sccc2n1 271570a_100011290941_100012000956 [1,0,0,0,1,0|2,0,0]=4 862 B14R1.818 NC(=O)CC(=O)C=Cc1ccccc1 1458a_100000210462_100000187820 [0,0,1,0,0,1|2,0,0]=4 863 B14R1.818 O=C([O-])CC(=O)C=Cc1ccccc1 1458a_100000210462_100020667443 [0,0,1,0,0,1|1,0,1]=4 864 B16R2.477 C=C(C)CNc1ccc2ccccc2n1 27a_100000765925_100011291633 [0,0,0,0,0,2|2,0,0]=4 865 B16R2.477 C=C(C)CSc1ccc2ccccc2n1 62a_100000748629_100011291633 [0,0,0,0,0,2|2,0,0]=4 866 B16R2.477 C=C(C)CSc1ccc2ccccc2n1 62a_100011291633_100000211660 [0,0,0,0,0,2|2,0,0]=4 867 B16R2.477 C=C(F)CSc1ccc2ccccc2n1 62a_100000042424_100011291633 [0,0,0,0,0,2|2,0,0]=4 868 B16R2.477 C=C(F)CSc1ccc2ccccc2n1 62a_100011291633_100000042424 [0,0,0,0,0,2|2,0,0]=4 869 B16R2.477 CC(=O)C=Cc1ccc2ccccc2n1 1458a_100000184337_200000210301 [0,0,0,0,0,2|1,0,0]=3 870 B16R2.477 CC(=O)CCc1ccc2ccccc2c1 1458a_100000743016_200000210301 [0,0,0,0,0,2|2,0,0]=4 871 B16R2.477 CC(=O)COc1ccc2ccccc2c1 1458a_100000185456_200000210301 [0,0,0,0,0,2|2,0,0]=4 872 B16R2.477 CC(=O)CSc1ccc2ccccc2c1 1458a_100000181792_200000210301 [0,0,0,0,0,2|2,0,0]=4 873 B16R2.477 CC(=O)CSc1cnc2ccccc2n1 1458a_100000185120_200000210301 [0,0,0,0,0,2|2,0,0]=4 874 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 11a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 875 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 1626a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 876 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 240690a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 877 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 527a_100000739491_100103153847 [0,0,0,0,0,2|2,0,0]=4 878 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 11a_100015185970_100015343762 [0,0,0,0,0,2|1,0,0]=3 879 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 1626a_100015185970_100015343762 [0,0,0,0,0,2|1,0,0]=3 880 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 240690a_100015185970_100015343762 [0,0,0,0,0,2|1,0,0]=3 881 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 527a_100015185970_100103153847 [0,0,0,0,0,2|1,0,0]=3 882 B16R2.477 CC(=O)NNc1ccc2ccccc2c1 22a_100016987534_100000070787 [0,0,0,0,0,2|2,0,0]=4 883 B16R2.477 CC(=O)NNc1ccc2ccccc2n1 22a_100000212036_100000070787 [0,0,0,0,0,2|1,0,0]=3 884 B16R2.477 CC(=O)NNc1cnc2ccccc2n1 22a_100000199685_100000070787 [0,0,0,0,0,2|2,0,0]=4 885 B16R2.477 CC(O)C=Cc1ccc2ccccc2n1 271570a_200011019289_100011291633 [0,0,0,0,0,2|1,0,1]=4 886 B16R2.477 CC(O)CNc1ccc2ccccc2n1 27a_100000210904_100011291633 [0,0,0,0,0,2|1,0,1]=4 887 B16R2.477 CC(O)CSc1ccc2ccccc2n1 62a_100011218427_100011291633 [0,0,0,0,0,2|1,0,1]=4 888 B16R2.477 CC(O)CSc1ccc2ccccc2n1 62a_100011291633_100011218427 [0,0,0,0,0,2|1,0,1]=4 889 B16R2.477 C[C@@H](O)CSc1ccc2ccccc2n1 62a_100009817552_100011291633 [0,0,0,0,0,2|1,0,1]=4 890 B16R2.477 C[C@@H](O)CSc1ccc2ccccc2n1 62a_100011291633_100009817552 [0,0,0,0,0,2|1,0,1]=4 891 B16R2.477 NC(=O)CNc1ccc2ccccc2c1 34a_100000211940_100000187820 [0,0,0,0,0,2|2,0,0]=4 892 B16R2.477 NC(=O)CNc1ccc2ccccc2c1 7a_100000211940_100000187820 [0,0,0,0,0,2|2,0,0]=4 893 B16R2.477 NC(=O)COc1ccc2ccccc2c1 34a_100000185828_100000187820 [0,0,0,0,0,2|2,0,0]=4 894 B16R2.477 NC(=O)COc1ccc2ccccc2c1 7a_100000185828_100000187820 [0,0,0,0,0,2|2,0,0]=4 895 B16R2.477 NC(=O)CSc1ccc2ccccc2c1 62a_100000747473_100000233703 [0,0,0,0,0,2|2,0,0]=4 896 B16R2.477 NC(=O)CSc1ccc2ccccc2n1 62a_100000747473_100011291633 [0,0,0,0,0,2|1,0,0]=3 897 B16R2.477 NC(=O)CSc1ccc2ccccc2n1 62a_100011291633_100000747473 [0,0,0,0,0,2|1,0,0]=3 898 B16R2.477 NC(=O)CSc1ccc2cccnc2n1 62a_100000075685_100000747473 [0,0,0,0,0,2|2,0,0]=4 899 B16R2.477 NC(=O)CSc1ccc2cccnc2n1 62a_100000747473_100000075685 [0,0,0,0,0,2|2,0,0]=4 900 B16R2.477 NC(=O)CSc1ccc2ccncc2n1 62a_100000747473_100000020162 [0,0,0,0,0,2|2,0,0]=4 901 B16R2.477 NC(=O)CSc1ccc2ncccc2n1 62a_100000747473_100000073381 [0,0,0,0,0,2|2,0,0]=4 902 B16R2.477 NC(=O)CSc1cnc2ccccc2n1 62a_100000747473_100000756483 [0,0,0,0,0,2|2,0,0]=4 903 B16R2.477 NC(=O)CSc1cnc2ccccc2n1 62a_100000756483_100000747473 [0,0,0,0,0,2|2,0,0]=4 904 B16R2.477 NC(=O)CSc1ncc2ccccc2n1 62a_100000747473_100000097389 [0,0,0,0,0,2|2,0,0]=4 905 B16R2.477 O=C([O-])CNc1ccc2ccccc2c1 34a_100000211940_100020667443 [0,0,0,0,0,2|1,0,1]=4 906 B16R2.477 O=C([O-])COc1ccc2ccccc2c1 34a_100000185828_100020667443 [0,0,0,0,0,2|1,0,1]=4 907 B16R2.477 O=C([O-])CSc1ccc2ccccc2c1 62a_100020667443_100000233703 [0,0,0,0,0,2|1,0,1]=4 908 B16R2.477 O=C([O-])CSc1ccc2ccccc2n1 62a_100011291633_100020667443 [0,0,0,0,0,2|0,0,1]=3 909 B16R2.477 O=C([O-])CSc1ccc2ccccc2n1 62a_100020667443_100011291633 [0,0,0,0,0,2|0,0,1]=3 910 B16R2.477 O=C([O-])CSc1ccc2cccnc2n1 62a_100000075685_100020667443 [0,0,0,0,0,2|1,0,1]=4 911 B16R2.477 O=C([O-])CSc1ccc2cccnc2n1 62a_100020667443_100000075685 [0,0,0,0,0,2|1,0,1]=4 912 B16R2.477 O=C([O-])CSc1ccc2ccncc2n1 62a_100020667443_100000020162 [0,0,0,0,0,2|1,0,1]=4 913 B16R2.477 O=C([O-])CSc1ccc2ncccc2n1 62a_100020667443_100000073381 [0,0,0,0,0,2|1,0,1]=4 914 B16R2.477 O=C([O-])CSc1cnc2ccccc2n1 62a_100000756483_100020667443 [0,0,0,0,0,2|1,0,1]=4 915 B16R2.477 O=C([O-])CSc1cnc2ccccc2n1 62a_100020667443_100000756483 [0,0,0,0,0,2|1,0,1]=4 916 B16R2.477 O=C([O-])CSc1ncc2ccccc2n1 62a_100020667443_100000097389 [0,0,0,0,0,2|1,0,1]=4 917 B16R2.477 O=[N+]([O-])CSc1ccc2ccccc2n1 62a_100011291633_100000761209 [0,0,0,0,0,2|1,0,1]=4 918 B16R2.477 [13CH3]C(=O)C=Cc1ccc2ccccc2n1 1458a_100000184337_200025704644 [0,0,0,0,0,2|1,0,0]=3 919 B16R2.477 [13CH3]C(=O)CCc1ccc2ccccc2c1 1458a_100000743016_200025704644 [0,0,0,0,0,2|2,0,0]=4 920 B16R2.477 [13CH3]C(=O)COc1ccc2ccccc2c1 1458a_100000185456_200025704644 [0,0,0,0,0,2|2,0,0]=4 921 B16R2.477 [13CH3]C(=O)CSc1ccc2ccccc2c1 1458a_100000181792_200025704644 [0,0,0,0,0,2|2,0,0]=4 922 B16R2.477 [13CH3]C(=O)CSc1cnc2ccccc2n1 1458a_100000185120_200025704644 [0,0,0,0,0,2|2,0,0]=4