0 B26R3.39785884 O=C(CCCCCCCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_200009813472 [0,0,0,0,0,0|3,0,0]=3 1 B26R3.39785884 O=C(CCCCCCCc1ccccc1)C2Cc3ccccc3C2 1458a_100000685393_200009813472 [0,0,0,0,0,0|3,0,1]=4 2 B26R3.39785884 O=C(CCCCCCCc1ccccc1)C2Cc3ccccc3C2 1458a_200000034917_100000753484 [0,0,0,0,0,0|3,0,1]=4 3 B26R3.39785884 O=C(CCCCCCCc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_200009813472 [0,0,0,0,0,0|2,0,1]=3 4 B26R3.39785884 O=C(CCCCCCCc1ccccc1)C2Cc3ccccc3S2 1458a_100000024912_200009813472 [0,0,0,0,0,0|2,1,1]=4 5 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3ccccc3C2 11a_100000752595_200000034917 [0,0,0,0,0,0|4,0,0]=4 6 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3ccccc3C2 1626a_100000752595_200000034917 [0,0,0,0,0,0|4,0,0]=4 7 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3ccccc3C2 240690a_100000752595_200000034917 [0,0,0,0,0,0|4,0,0]=4 8 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3ccccc3C2 527a_100000752595_200000034917 [0,0,0,0,0,0|4,0,0]=4 9 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cccnc3C2 11a_100000726175_200000034917 [0,0,0,0,0,0|3,0,0]=3 10 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cccnc3C2 1626a_100000726175_200000034917 [0,0,0,0,0,0|3,0,0]=3 11 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cccnc3C2 240690a_100000726175_200000034917 [0,0,0,0,0,0|3,0,0]=3 12 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cccnc3C2 527a_100000726175_200000034917 [0,0,0,0,0,0|3,0,0]=3 13 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cncnc3C2 11a_100015200256_200000034917 [0,0,0,0,0,0|4,0,0]=4 14 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cncnc3C2 240690a_100015200256_200000034917 [0,0,0,0,0,0|4,0,0]=4 15 B26R3.39785884 O=C(CCCCCCCc1ccccc1)N2Cc3cncnc3C2 527a_100015200256_200000034917 [0,0,0,0,0,0|4,0,0]=4 16 B26R3.39785884 O=C(CCCCCCOc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_200012047174 [0,0,0,0,0,0|4,0,0]=4 17 B26R3.39785884 O=C(CCCCCCOc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_200012047174 [0,0,0,0,0,0|3,0,1]=4 18 B26R3.39785884 O=C(CCCCCOCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100012032903 [0,0,0,0,0,0|4,0,0]=4 19 B26R3.39785884 O=C(CCCCCOCc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_100012032903 [0,0,0,0,0,0|3,0,1]=4 20 B26R3.39785884 O=C(CNCCCCCc1ccccc1)c2cc3ccccc3s2 2230a_100000750932_100012351422 [0,0,0,0,0,0|3,1,0]=4 21 B26R3.39785884 O=C(CNCCCCCc1ccccc1)c2nc3ccccc3s2 2230a_100000750932_100000198972 [0,0,0,0,0,0|2,1,0]=3 22 B26R3.39785884 O=C(CNCCCOCc1ccccc1)c2nc3ccccc3s2 2230a_200000206031_100000198972 [0,0,0,0,0,0|3,1,0]=4 23 B26R3.39785884 O=C(COCCCCCc1ccccc1)c2cc3ccccc3s2 7a_200011219639_100012351422 [0,0,0,0,0,0|3,1,0]=4 24 B26R3.39785884 O=C(CSCCCCCc1ccccc1)c2cc3ccccc3o2 62a_200011217138_100000209828 [0,0,0,0,0,0|3,0,0]=3 25 B26R3.39785884 O=C(CSCCCCCc1ccccc1)c2nc3ccccc3s2 62a_100000198972_200011217138 [0,0,0,0,0,0|2,1,0]=3 26 B26R3.39785884 O=C(CSCCCCOc1ccccc1)c2cc3ccccc3o2 62a_100011215240_100000209828 [0,0,0,0,0,0|4,0,0]=4 27 B26R3.39785884 O=C(CSCCCCOc1ccccc1)c2nc3ccccc3s2 62a_100000198972_100011215240 [0,0,0,0,0,0|3,1,0]=4 28 B26R3.39785884 O=C(CSCCCOCc1ccccc1)c2cc3ccccc3o2 62a_100011215529_100000209828 [0,0,0,0,0,0|4,0,0]=4 29 B26R3.39785884 O=C(CSCCCOCc1ccccc1)c2nc3ccccc3s2 62a_100000198972_100011215529 [0,0,0,0,0,0|3,1,0]=4 30 B25R3.6103231 c1ccc(cc1)CCCCCCCSc2nc3cccnc3s2 62a_100010188088_200009813472 [1,0,0,0,0,0|3,0,0]=4 31 B25R3.6103231 c1ccc(cc1)CCCCCCOCc2nc3ccccc3o2 34a_100011215581_200012361514 [1,0,0,0,0,0|2,0,1]=4 32 B25R3.6103231 c1ccc(cc1)CCCCCCOCc2nc3ccccc3o2 7a_100011215581_100000195508 [1,0,0,0,0,0|2,0,1]=4 33 B25R3.6103231 c1ccc(cc1)CCCCCCOCc2nc3ncccc3o2 7a_100011215581_100000696355 [1,0,0,0,0,0|1,0,1]=3 34 B25R3.6103231 c1ccc(cc1)CCCCCCSCc2nc3ccccc3o2 62a_100011218729_100000195508 [1,0,0,0,0,0|2,0,1]=4 35 B25R3.6103231 c1ccc(cc1)CCCCCCSCc2nc3ncccc3o2 62a_100011218729_100000696355 [1,0,0,0,0,0|1,0,1]=3 36 B25R3.6103231 c1ccc(cc1)COCCCCNCc2nc3ncccc3o2 2230a_100000748060_100000696355 [1,0,0,0,0,0|2,0,1]=4 37 B25R3.6103231 c1ccc(cc1)COCCCCOCc2nc3ncccc3o2 7a_100011215074_100000696355 [1,0,0,0,0,0|2,0,1]=4 38 B25R3.6103231 c1ccc(cc1)COCCCCSCc2nc3ncccc3o2 62a_100011219843_100000696355 [1,0,0,0,0,0|2,0,1]=4 39 B25R3.6103231 c1ccc(cc1)OCCCCCSCc2nc3ncccc3o2 62a_200011777167_100000696355 [1,0,0,0,0,0|2,0,1]=4 40 B27R3.3735503 Cc1c(oc2c1cccc2)C(=O)CNCCCCCc3ccccc3 2230a_100000750932_100000684729 [0,1,0,0,0,0|3,0,0]=4 41 B27R3.20474539 Cc1ccc2c(c1)OC(C2)C(=O)CCCCCCCc3ccccc3 1458a_100009922052_200009813472 [0,1,0,0,0,0|2,0,1]=4 42 B27R3.20474539 O=C(CCCCCCCc1ccccc1)C2Cc3cc(ccc3O2)O 1458a_200009830173_200009813472 [0,1,0,0,0,0|2,0,1]=4 43 B27R3.20474539 O=C(CCCCCCCc1ccccc1)N2Cc3ccc(nc3C2)Cl 11a_100016995040_200000034917 [0,1,0,0,0,0|3,0,0]=4 44 B27R3.20474539 O=C(CCCCCCCc1ccccc1)N2Cc3ccc(nc3C2)Cl 1626a_100016995040_200000034917 [0,1,0,0,0,0|3,0,0]=4 45 B27R3.20474539 O=C(CCCCCCCc1ccccc1)N2Cc3ccc(nc3C2)Cl 240690a_100016995040_200000034917 [0,1,0,0,0,0|3,0,0]=4 46 B27R3.20474539 O=C(CCCCCCCc1ccccc1)N2Cc3ccc(nc3C2)Cl 527a_100016995040_200000034917 [0,1,0,0,0,0|3,0,0]=4 47 B27R3.20474539 O=C(CNCCCCCc1ccccc1)c2cc3cc(ccc3o2)Br 34a_100000750932_100010170448 [0,1,0,0,0,0|3,0,0]=4 48 B27R3.20474539 O=C(COCCCCCc1ccccc1)c2cc3cc(ccc3o2)Br 34a_200011219639_100010170448 [0,1,0,0,0,0|3,0,0]=4 49 B27R3.287560044 O=C(CCCCCc1ccccc1)CC(=O)c2cc3ccccc3o2 1458a_100011216832_100000209828 [0,1,0,0,0,0|2,0,1]=4 50 B25R2.218918 Cc1ccccc1OCC(=O)CCCCCCCc2ccccc2 1458a_100000182418_200009813472 [0,0,1,0,0,0|2,0,1]=4 51 B25R2.218918 Cc1cccnc1CNC(=O)CCCCCCCc2ccccc2 11a_100011223789_200000034917 [0,0,1,0,0,0|3,0,0]=4 52 B25R2.218918 Cc1cccnc1CNC(=O)CCCCCCCc2ccccc2 1626a_100011223789_200000034917 [0,0,1,0,0,0|3,0,0]=4 53 B25R2.218918 Cc1cccnc1CNC(=O)CCCCCCCc2ccccc2 240690a_100011223789_200000034917 [0,0,1,0,0,0|3,0,0]=4 54 B25R2.218918 Cc1cccnc1CNC(=O)CCCCCCCc2ccccc2 527a_100011223789_200000034917 [0,0,1,0,0,0|3,0,0]=4 55 B25R2.218918 Cc1cccnc1NNC(=O)CCCCCCCc2ccccc2 22a_100000708268_200000034917 [0,0,1,0,0,0|2,0,1]=4 56 B25R2.218918 Cc1ncccc1NNC(=O)CCCCCCCc2ccccc2 22a_100000730703_200000034917 [0,0,1,0,0,0|3,0,0]=4 57 B25R2.218918 O=C(C=Cc1ccccc1F)CCCCCCCc2ccccc2 1458a_100016256065_200009813472 [0,0,1,0,0,0|3,0,0]=4 58 B25R2.218918 O=C(C=Cc1ccccc1O)CCCCCCCc2ccccc2 1458a_100016263591_200009813472 [0,0,1,0,0,0|2,0,0]=3 59 B25R2.218918 O=C(C=Cc1ccccc1O)CCCCCCOc2ccccc2 1458a_100016263591_200012047174 [0,0,1,0,0,0|3,0,0]=4 60 B25R2.218918 O=C(C=Cc1ccccc1O)CCCCCOCc2ccccc2 1458a_100016263591_100012032903 [0,0,1,0,0,0|3,0,0]=4 61 B25R2.218918 O=C(CCCCCCCc1ccccc1)CCc2ccccc2O 1458a_100000181328_200009813472 [0,0,1,0,0,0|2,0,1]=4 62 B25R2.218918 O=C(CCCCCCCc1ccccc1)CCc2ccccc2O 1458a_200000034917_100000722297 [0,0,1,0,0,0|2,0,1]=4 63 B25R2.218918 O=C(CCCCCCCc1ccccc1)COc2ccccc2Br 1458a_100000216496_200009813472 [0,0,1,0,0,0|2,0,1]=4 64 B25R2.218918 O=C(CCCCCCCc1ccccc1)COc2ccccc2Cl 1458a_100000185159_200009813472 [0,0,1,0,0,0|2,0,1]=4 65 B25R2.218918 O=C(CCCCCCCc1ccccc1)COc2ccccc2F 1458a_100000182486_200009813472 [0,0,1,0,0,0|2,0,1]=4 66 B25R2.218918 O=C(CCCCCCCc1ccccc1)COc2ccccc2O 1458a_100000183020_200009813472 [0,0,1,0,0,0|2,0,1]=4 67 B25R2.218918 O=C(CCCCCCCc1ccccc1)CSc2ccccc2O 1458a_100000695322_200009813472 [0,0,1,0,0,0|2,0,1]=4 68 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ccccc2O 240690a_100000185550_200000034917 [0,0,1,0,0,0|3,0,0]=4 69 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ccccc2O 527a_100000185550_200000034917 [0,0,1,0,0,0|3,0,0]=4 70 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Br 11a_100009818023_200000034917 [0,0,1,0,0,0|3,0,0]=4 71 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Br 240690a_100009818023_200000034917 [0,0,1,0,0,0|3,0,0]=4 72 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Br 527a_100009818023_200000034917 [0,0,1,0,0,0|3,0,0]=4 73 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Cl 11a_100015189234_200000034917 [0,0,1,0,0,0|3,0,0]=4 74 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Cl 1626a_100015189234_200000034917 [0,0,1,0,0,0|3,0,0]=4 75 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Cl 240690a_100015189234_200000034917 [0,0,1,0,0,0|3,0,0]=4 76 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2Cl 527a_100015189234_200000034917 [0,0,1,0,0,0|3,0,0]=4 77 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2F 11a_100000724633_200000034917 [0,0,1,0,0,0|3,0,0]=4 78 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2F 1626a_100000724633_200000034917 [0,0,1,0,0,0|3,0,0]=4 79 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2F 240690a_100000724633_200000034917 [0,0,1,0,0,0|3,0,0]=4 80 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2cccnc2F 527a_100000724633_200000034917 [0,0,1,0,0,0|3,0,0]=4 81 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Br 11a_100020591323_200000034917 [0,0,1,0,0,0|3,0,0]=4 82 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Br 240690a_100020591323_200000034917 [0,0,1,0,0,0|3,0,0]=4 83 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Br 527a_100020591323_200000034917 [0,0,1,0,0,0|3,0,0]=4 84 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Cl 11a_100015189233_200000034917 [0,0,1,0,0,0|3,0,0]=4 85 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Cl 1626a_100015189233_200000034917 [0,0,1,0,0,0|3,0,0]=4 86 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Cl 240690a_100015189233_200000034917 [0,0,1,0,0,0|3,0,0]=4 87 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2Cl 527a_100015189233_200000034917 [0,0,1,0,0,0|3,0,0]=4 88 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2F 11a_100000690088_200000034917 [0,0,1,0,0,0|3,0,0]=4 89 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2F 1626a_100000690088_200000034917 [0,0,1,0,0,0|3,0,0]=4 90 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2F 240690a_100000690088_200000034917 [0,0,1,0,0,0|3,0,0]=4 91 B25R2.218918 O=C(CCCCCCCc1ccccc1)NCc2ncccc2F 527a_100000690088_200000034917 [0,0,1,0,0,0|3,0,0]=4 92 B25R2.218918 O=C(CCCCCCCc1ccccc1)NNc2ncccc2Br 22a_100011464834_200000034917 [0,0,1,0,0,0|2,0,1]=4 93 B25R2.218918 O=C(CCCCCCCc1ccccc1)NNc2ncccc2Cl 22a_100000741667_200000034917 [0,0,1,0,0,0|2,0,1]=4 94 B25R2.218918 O=C(CCCCCCCc1ccccc1)NNc2ncccc2F 22a_100000717775_200000034917 [0,0,1,0,0,0|2,0,1]=4 95 B25R2.218918 O=C(CCCCCCCc1ccccc1)NNc2ncccc2I 22a_100010221029_200000034917 [0,0,1,0,0,0|2,0,1]=4 96 B25R2.741402 C/C(=C\c1ccccn1)/C(=O)CCCCCCCc2ccccc2 1458a_100025712827_200009813472 [0,0,1,0,0,0|2,0,0]=3 97 B25R2.741402 C/C(=C\c1ccccn1)/C(=O)CCCCCCOc2ccccc2 1458a_100025712827_200012047174 [0,0,1,0,0,0|3,0,0]=4 98 B25R2.741402 C/C(=C\c1ccccn1)/C(=O)CCCCCOCc2ccccc2 1458a_100025712827_100012032903 [0,0,1,0,0,0|3,0,0]=4 99 B25R2.741402 CC(Cc1ccccn1)C(=O)CCCCCCCc2ccccc2 1458a_100012000792_200009813472 [0,0,1,0,0,0|2,0,1]=4 100 B25R2.741402 CC(Oc1ccccc1)C(=O)CCCCCCCc2ccccc2 1458a_100000188414_200009813472 [0,0,1,0,0,0|2,0,1]=4 101 B25R2.741402 CC(Sc1ccccn1)C(=O)CCCCCCCc2ccccc2 1458a_100000156770_200009813472 [0,0,1,0,0,0|2,0,1]=4 102 B25R2.741402 CN(Cc1ccccn1)C(=O)CCCCCCCc2ccccc2 11a_100000207498_200000034917 [0,0,1,0,0,0|3,0,0]=4 103 B25R2.741402 CN(Cc1ccccn1)C(=O)CCCCCCCc2ccccc2 240690a_100000207498_200000034917 [0,0,1,0,0,0|3,0,0]=4 104 B25R2.741402 CN(Cc1ccccn1)C(=O)CCCCCCCc2ccccc2 527a_100000207498_200000034917 [0,0,1,0,0,0|3,0,0]=4 105 B25R2.741402 CN(Cc1cccnc1)C(=O)CCCCCCCc2ccccc2 11a_100000184577_200000034917 [0,0,1,0,0,0|3,0,0]=4 106 B25R2.741402 CN(Cc1cccnc1)C(=O)CCCCCCCc2ccccc2 240690a_100000184577_200000034917 [0,0,1,0,0,0|3,0,0]=4 107 B25R2.741402 CN(Cc1cccnc1)C(=O)CCCCCCCc2ccccc2 527a_100000184577_200000034917 [0,0,1,0,0,0|3,0,0]=4 108 B25R2.741402 O=C(CCCCCCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200009813472 [0,0,1,0,0,0|2,0,0]=3 109 B25R2.741402 O=C(CCCCCCCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_200009813472 [0,0,1,0,0,0|1,0,2]=4 110 B25R2.741402 O=C(CCCCCCCc1ccccc1)[C@H](O)Cc2ccccc2 1458a_100009816399_200009813472 [0,0,1,0,0,0|2,0,1]=4 111 B25R2.741402 O=C(CCCCCCOc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200012047174 [0,0,1,0,0,0|3,0,0]=4 112 B25R2.741402 O=C(CCCCCOCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100012032903 [0,0,1,0,0,0|3,0,0]=4 113 B27R4.4354745 O=C(CN1CCCCC1c2ccccc2)c3cc4ccccc4o3 269982a_100000707174_100000209828 [0,0,0,1,0,0|3,0,0]=4 114 B27R4.4354745 O=C(CN1CCCCC1c2ccccc2)c3nc4ccccc4s3 2230a_100000707174_100000198972 [0,0,0,1,0,0|2,1,0]=4 115 B27R4.4354745 O=C(CN1CCCCC1c2ccccc2)c3nc4ccccc4s3 269982a_100000707174_100000198972 [0,0,0,1,0,0|2,1,0]=4 116 B27R4.30395980 O=C(CN1CCCC1Cc2ccccc2)c3cc4ccccc4o3 269982a_100159249835_100000209828 [0,0,0,1,0,0|3,0,0]=4 117 B27R4.30395980 O=C(CN1CCCC1Cc2ccccc2)c3nc4ccccc4s3 2230a_100159249835_100000198972 [0,0,0,1,0,0|2,1,0]=4 118 B27R4.30395980 O=C(CN1CCCC1Cc2ccccc2)c3nc4ccccc4s3 269982a_100159249835_100000198972 [0,0,0,1,0,0|2,1,0]=4 119 B27R4.30460497 O=C(CN[C@@H]1CCC[C@@H]1c2ccccc2)c3nc4ccccc4s3 2230a_100009885948_100000198972 [0,0,0,1,0,0|2,1,0]=4 120 B25R3.3981647 O=C(CCCCCCCc1ccccc1)C2Cc3c2cccc3 1458a_200000238571_200009813472 [0,0,0,0,1,0|2,0,1]=4 121 B25R3.32645266 O=C(CCCCCCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100011218729 [0,0,0,0,1,0|3,0,0]=4 122 B25R3.32645266 O=C(CCCCCCc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_100011218729 [0,0,0,0,1,0|2,0,1]=4 123 B25R3.32645266 O=C(CCCCCCc1ccccc1)N2Cc3cccnc3C2 11a_100000726175_100000036270 [0,0,0,0,1,0|3,0,0]=4 124 B25R3.32645266 O=C(CCCCCCc1ccccc1)N2Cc3cccnc3C2 1626a_100000726175_100000036270 [0,0,0,0,1,0|3,0,0]=4 125 B25R3.32645266 O=C(CCCCCCc1ccccc1)N2Cc3cccnc3C2 240690a_100000726175_100000036270 [0,0,0,0,1,0|3,0,0]=4 126 B25R3.32645266 O=C(CCCCCCc1ccccc1)N2Cc3cccnc3C2 527a_100000726175_100000036270 [0,0,0,0,1,0|3,0,0]=4 127 B25R3.32645266 O=C(CNCCCCc1ccccc1)c2nc3ccccc3s2 2230a_100015280158_100000198972 [0,0,0,0,1,0|2,1,0]=4 128 B25R3.32645266 O=C(CSCCCCc1ccccc1)c2cc3ccccc3o2 62a_100000701786_100000209828 [0,0,0,0,1,0|3,0,0]=4 129 B25R3.32645266 O=C(CSCCCCc1ccccc1)c2nc3ccccc3s2 62a_100000198972_100000701786 [0,0,0,0,1,0|2,1,0]=4 130 B27R3.5024880 O=C(CCCCCCCc1ccccc1)C2=Cc3ccccc3OC2 1458a_100000018039_200009813472 [0,0,0,0,0,1|2,0,0]=3 131 B27R3.5024880 O=C(CCCCCCCc1ccccc1)C2CCc3ccccc3O2 1458a_100000065239_200009813472 [0,0,0,0,0,1|2,0,1]=4 132 B27R3.5024880 O=C(CCCCCCCc1ccccc1)C2COc3ccccc3C2 1458a_100000203760_200009813472 [0,0,0,0,0,1|2,0,1]=4 133 B27R3.5024880 O=C(CCCCCCCc1ccccc1)C2COc3ccccc3O2 1458a_100000182656_200009813472 [0,0,0,0,0,1|2,0,1]=4 134 B27R3.5024880 O=C(CCCCCCCc1ccccc1)C2Cc3ccccc3CO2 1458a_100009880028_200009813472 [0,0,0,0,0,1|2,0,1]=4 135 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3cccnc3C2 11a_100015206102_200000034917 [0,0,0,0,0,1|3,0,0]=4 136 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3cccnc3C2 1626a_100015206102_200000034917 [0,0,0,0,0,1|3,0,0]=4 137 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3cccnc3C2 240690a_100015206102_200000034917 [0,0,0,0,0,1|3,0,0]=4 138 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3cccnc3C2 527a_100015206102_200000034917 [0,0,0,0,0,1|3,0,0]=4 139 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3ncccc3C2 11a_100000699647_200000034917 [0,0,0,0,0,1|3,0,0]=4 140 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3ncccc3C2 240690a_100000699647_200000034917 [0,0,0,0,0,1|3,0,0]=4 141 B27R3.5024880 O=C(CCCCCCCc1ccccc1)N2CCc3ncccc3C2 527a_100000699647_200000034917 [0,0,0,0,0,1|3,0,0]=4 142 B27R3.5024880 O=C(CCCCCCCc1ccccc1)c2ccc3nccnc3c2 1458a_100000184533_200009813472 [0,0,0,0,0,1|3,0,0]=4 143 B27R3.5024880 O=C(CCCCCCOc1ccccc1)C2=Cc3ccccc3OC2 1458a_100000018039_200012047174 [0,0,0,0,0,1|3,0,0]=4 144 B27R3.5024880 O=C(CCCCCCOc1ccccc1)c2ccc3cccnc3c2 1458a_100011933907_200012047174 [0,0,0,0,0,1|3,0,0]=4 145 B27R3.5024880 O=C(CCCCCCOc1ccccc1)c2ccc3ncccc3c2 1458a_100011216044_200012047174 [0,0,0,0,0,1|3,0,0]=4 146 B27R3.5024880 O=C(CCCCCOCc1ccccc1)C2=Cc3ccccc3OC2 1458a_100000018039_100012032903 [0,0,0,0,0,1|3,0,0]=4 147 B27R3.5024880 O=C(CCCCCOCc1ccccc1)c2ccc3cccnc3c2 1458a_100011933907_100012032903 [0,0,0,0,0,1|3,0,0]=4 148 B27R3.5024880 O=C(CCCCCOCc1ccccc1)c2ccc3ncccc3c2 1458a_100011216044_100012032903 [0,0,0,0,0,1|3,0,0]=4 149 B27R3.44110942 O=C(CCCCCCCCc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_100009814296 [0,0,0,0,0,1|2,0,1]=4 150 B27R3.44110942 O=C(CCCCCCOCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100012047231 [0,0,0,0,0,1|3,0,0]=4 151 B27R3.44110942 O=C(CCCCCCOCc1ccccc1)C2Cc3ccccc3O2 1458a_100000209886_100012047231 [0,0,0,0,0,1|2,0,1]=4 152 B27R3.44110942 O=C(CNCCCCOCc1ccccc1)c2nc3ccccc3s2 2230a_100000748060_100000198972 [0,0,0,0,0,1|2,1,0]=4 153 B27R3.44110942 O=C(COCCCCCCc1ccccc1)c2cc3ccccc3s2 7a_100011215581_100012351422 [0,0,0,0,0,1|2,1,0]=4 154 B27R3.44110942 O=C(CSCCCCCOc1ccccc1)c2cc3ccccc3o2 62a_200011777167_100000209828 [0,0,0,0,0,1|3,0,0]=4 155 B27R3.44110942 O=C(CSCCCCCOc1ccccc1)c2nc3ccccc3s2 62a_100000198972_200011777167 [0,0,0,0,0,1|2,1,0]=4 156 B27R3.44110942 O=C(CSCCCCOCc1ccccc1)c2cc3ccccc3o2 62a_100011219843_100000209828 [0,0,0,0,0,1|3,0,0]=4 157 B27R3.44110942 O=C(CSCCCCOCc1ccccc1)c2nc3ccccc3s2 62a_100000198972_100011219843 [0,0,0,0,0,1|2,1,0]=4 158 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2cn3ccccc3n2 1458a_200000034917_100000689847 [0,0,0,0,0,1|3,0,0]=4 159 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3ccccc3[nH]2 1458a_200000034917_100000737899 [0,0,0,0,0,1|2,0,0]=3 160 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_200009813472 [0,0,0,0,0,1|1,0,0]=2 161 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3ccccc3o2 1458a_200000034917_100000195508 [0,0,0,0,0,1|1,0,0]=2 162 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3ccccc3s2 1458a_200000034917_100011217541 [0,0,0,0,0,1|1,1,0]=3 163 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3cccnc3[nH]2 1458a_200000034917_100011549802 [0,0,0,0,0,1|1,0,1]=3 164 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cc2nc3ncccc3o2 1458a_200000034917_100000696355 [0,0,0,0,0,1|0,0,0]=1 165 B27R3.44211927 O=C(CCCCCCCc1ccccc1)Cn2cc3ccccc3n2 1458a_100000060251_200009813472 [0,0,0,0,0,1|3,0,0]=4 166 B27R3.44211927 O=C(CCCCCCOc1ccccc1)Cc2cc3ccccc3o2 1458a_100000735538_200012047174 [0,0,0,0,0,1|3,0,0]=4 167 B27R3.44211927 O=C(CCCCCCOc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_200012047174 [0,0,0,0,0,1|2,0,0]=3 168 B27R3.44211927 O=C(CCCCCOCc1ccccc1)Cc2cc3ccccc3o2 1458a_100000735538_100012032903 [0,0,0,0,0,1|3,0,0]=4 169 B27R3.44211927 O=C(CCCCCOCc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_100012032903 [0,0,0,0,0,1|2,0,0]=3 170 B27R3.44211927 O=C(CCNCCCCc1ccccc1)Nc2nc3ccccc3s2 2230a_100015280158_200011213626 [0,0,0,0,0,1|2,1,0]=4 171 B27R3.44211927 O=C(CCOCCCCc1ccccc1)Nc2nc3ccccc3s2 7a_100000703073_200011213626 [0,0,0,0,0,1|2,1,0]=4 172 B27R3.44211927 O=C(CCOCCOCc1ccccc1)Cc2nc3ccccc3o2 1458a_100011072030_100000195508 [0,0,0,0,0,1|3,0,0]=4 173 B27R3.44211927 O=C(CCOCCOCc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_100010883073 [0,0,0,0,0,1|3,0,0]=4 174 B27R3.44211927 O=C(CCOCCOCc1ccccc1)Cc2nc3ncccc3o2 1458a_100011072030_100000696355 [0,0,0,0,0,1|2,0,0]=3 175 B27R3.44211927 O=C(CNCCCCCc1ccccc1)Nc2nc3ccccc3[nH]2 2230a_100000750932_100011353410 [0,0,0,0,0,1|3,0,0]=4 176 B27R3.44211927 O=C(CNCCCCCc1ccccc1)Nc2nc3ccccc3s2 2230a_100000750932_100000752643 [0,0,0,0,0,1|2,1,0]=4 177 B27R3.44211927 O=C(COCCCCCc1ccccc1)Nc2nc3ccccc3s2 7a_200011219639_100000752643 [0,0,0,0,0,1|2,1,0]=4 178 B24R2.605969 O=C(C#Cc1ccccn1)CCCCCCCc2ccccc2 1458a_102125277312_200009813472 [1,0,1,0,0,0|1,0,1]=4 179 B24R2.605969 O=C(C=Cc1ccccc1)CCCCCCCc2ccccc2 1458a_100000210462_200009813472 [1,0,1,0,0,0|2,0,0]=4 180 B24R2.605969 O=C(C=Cc1ccccn1)CCCCCCCc2ccccc2 1458a_100000740811_200009813472 [1,0,1,0,0,0|1,0,0]=3 181 B24R2.605969 O=C(C=Cc1ccccn1)CCCCCCOc2ccccc2 1458a_100000740811_200012047174 [1,0,1,0,0,0|2,0,0]=4 182 B24R2.605969 O=C(C=Cc1ccccn1)CCCCCOCc2ccccc2 1458a_100000740811_100012032903 [1,0,1,0,0,0|2,0,0]=4 183 B24R2.605969 O=C(C=Cc1cccnc1)CCCCCCCc2ccccc2 1458a_100000735890_200009813472 [1,0,1,0,0,0|1,0,0]=3 184 B24R2.605969 O=C(C=Cc1cccnc1)CCCCCCOc2ccccc2 1458a_100000735890_200012047174 [1,0,1,0,0,0|2,0,0]=4 185 B24R2.605969 O=C(C=Cc1cccnc1)CCCCCOCc2ccccc2 1458a_100000735890_100012032903 [1,0,1,0,0,0|2,0,0]=4 186 B24R2.605969 O=C(CCCCCCCc1ccccc1)CCc2ccccn2 1458a_100015195070_200009813472 [1,0,1,0,0,0|1,0,1]=4 187 B24R2.605969 O=C(CCCCCCCc1ccccc1)CCc2ccccn2 1458a_200000034917_100015183660 [1,0,1,0,0,0|1,0,1]=4 188 B24R2.605969 O=C(CCCCCCCc1ccccc1)CCc2cccnc2 1458a_100000198484_200009813472 [1,0,1,0,0,0|1,0,1]=4 189 B24R2.605969 O=C(CCCCCCCc1ccccc1)CCc2cccnc2 1458a_200000034917_200011713674 [1,0,1,0,0,0|1,0,1]=4 190 B24R2.605969 O=C(CCCCCCCc1ccccc1)COc2ccccc2 1458a_100000186222_200009813472 [1,0,1,0,0,0|1,0,1]=4 191 B24R2.605969 O=C(CCCCCCCc1ccccc1)COc2ccccn2 1458a_100102699861_200009813472 [1,0,1,0,0,0|1,0,1]=4 192 B24R2.605969 O=C(CCCCCCCc1ccccc1)COc2cccnc2 1458a_100015207166_200009813472 [1,0,1,0,0,0|0,0,1]=3 193 B24R2.605969 O=C(CCCCCCCc1ccccc1)CSc2ccccn2 1458a_100000156281_200009813472 [1,0,1,0,0,0|1,0,1]=4 194 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2ccccn2 11a_100000210449_200000034917 [1,0,1,0,0,0|2,0,0]=4 195 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2ccccn2 1626a_100000210449_200000034917 [1,0,1,0,0,0|2,0,0]=4 196 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2ccccn2 240690a_100000210449_200000034917 [1,0,1,0,0,0|2,0,0]=4 197 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2ccccn2 527a_100000210449_200000034917 [1,0,1,0,0,0|2,0,0]=4 198 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2cccnc2 11a_100000210453_200000034917 [1,0,1,0,0,0|2,0,0]=4 199 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2cccnc2 240690a_100000210453_200000034917 [1,0,1,0,0,0|2,0,0]=4 200 B24R2.605969 O=C(CCCCCCCc1ccccc1)NCc2cccnc2 527a_100000210453_200000034917 [1,0,1,0,0,0|2,0,0]=4 201 B24R2.605969 O=C(CCCCCCCc1ccccc1)NNc2ccccn2 22a_100000183288_200000034917 [1,0,1,0,0,0|1,0,1]=4 202 B24R2.605969 O=C(CCCCCCCc1ccccc1)NNc2cccnc2 22a_100000728903_200000034917 [1,0,1,0,0,0|2,0,0]=4 203 B24R2.605969 O=C(CCCCCCOc1ccccc1)COc2cccnc2 1458a_100015207166_200012047174 [1,0,1,0,0,0|1,0,1]=4 204 B24R2.605969 O=C(CCCCCOCc1ccccc1)COc2cccnc2 1458a_100015207166_100012032903 [1,0,1,0,0,0|1,0,1]=4 205 B26R2.130860 COc1ccccc1C=CC(=O)CCCCCCCc2ccccc2 1458a_100000182468_200009813472 [0,1,1,0,0,0|2,0,0]=4 206 B26R2.130860 COc1cccnc1NNC(=O)CCCCCCCc2ccccc2 22a_100012020716_200000034917 [0,1,1,0,0,0|1,0,1]=4 207 B26R2.130860 COc1ncccc1C=CC(=O)CCCCCCCc2ccccc2 1458a_100102601226_200009813472 [0,1,1,0,0,0|2,0,0]=4 208 B26R2.188441 O=C(CCCCCCCc1ccccc1)C(=O)Nc2ccc(cn2)Cl 1458a_100011297360_200009813472 [0,1,1,0,0,0|0,0,2]=4 209 B26R3.39763824 O=C(CCCCCCc1ccccc1)Cc2nc3ncccc3o2 1458a_100000036270_100000696355 [1,1,0,0,0,0|0,0,2]=4 210 B28R3.4352517 O=C(CCCCCCCc1ccccc1)c2ccc3cccnc3c2O 1458a_100000036822_200009813472 [0,1,0,0,0,1|2,0,0]=4 211 B28R3.27990508 O=C(CCCCCCCc1ccccc1)c2ccc3nc(ccc3c2)O 1458a_100015838258_200009813472 [0,1,0,0,0,1|2,0,0]=4 212 B28R3.53575534 O=C(CCCCCCCc1ccccc1)c2cc(c3ncccc3c2)O 1458a_200009880037_200009813472 [0,1,0,0,0,1|2,0,0]=4 213 B28R3.426817578 O=C(CCCCCCc1ccccc1)CC(=O)c2cc3ccccc3o2 1458a_100000036270_100000209828 [0,1,0,0,0,1|2,0,0]=4 214 B28R3.4354616 Cn1c(nc2c1cccc2)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_100000748711 [0,1,0,0,0,1|2,0,0]=4 215 B28R3.28084202 Cc1ccc2nc([nH]c2c1)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_100020603265 [0,1,0,0,0,1|2,0,0]=4 216 B28R3.28084202 Cc1ccc2nc(oc2c1)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_100011295139 [0,1,0,0,0,1|1,0,0]=3 217 B28R3.28084202 Cc1ccc2oc(nc2c1)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_100011374149 [0,1,0,0,0,1|1,0,0]=3 218 B28R3.28084202 O=C(CCCCCCCc1ccccc1)Cc2nc3cc(ccc3[nH]2)Cl 1458a_200000034917_100000179801 [0,1,0,0,0,1|2,0,0]=4 219 B28R3.28084202 O=C(CCCCCCCc1ccccc1)Cc2nc3cc(ccc3o2)F 1458a_200000034917_100000687093 [0,1,0,0,0,1|1,0,0]=3 220 B28R3.28084202 O=C(CCCCCCCc1ccccc1)Cc2nc3ccc(cc3[nH]2)F 1458a_200000034917_200011347187 [0,1,0,0,0,1|2,0,0]=4 221 B28R3.28084202 O=C(CCCCCCCc1ccccc1)Cc2nc3ccc(cc3o2)F 1458a_200000034917_100000687025 [0,1,0,0,0,1|1,0,0]=3 222 B28R3.51337525 Cc1cccc2c1nc(o2)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_100011397728 [0,1,0,0,0,1|1,0,0]=3 223 B28R3.51337525 Cc1ccnc2c1nc([nH]2)CC(=O)CCCCCCCc3ccccc3 1458a_200000034917_200000699823 [0,1,0,0,0,1|1,0,1]=4 224 B28R3.61141228 O=C(CCCCC(=O)OCc1ccccc1)Cc2nc3ncccc3o2 1458a_100000048996_100000696355 [0,1,0,0,0,1|1,0,1]=4 225 B26R4.1648095 c1ccc(cc1)CCC2CCCN2Cc3nc4ncccc4o3 2230a_100000741814_100000696355 [1,0,0,1,0,0|1,0,1]=4 226 B26R4.1648626 c1ccc(cc1)[C@@H]2CCCC[C@H]2OCc3nc4ncccc4o3 7a_100009815809_100000696355 [1,0,0,1,0,0|1,0,1]=4 227 B26R4.1650687 c1ccc(cc1)CC2CCCCN2Cc3nc4ncccc4o3 2230a_100000748602_100000696355 [1,0,0,1,0,0|1,0,1]=4 228 B28R4.41200011 O=C(CN1CCCCC1Cc2ccccc2)c3cc4ccccc4o3 269982a_100000748602_100000209828 [0,0,0,1,0,1|2,0,0]=4 229 B28R4.41200011 O=C(CN1CCCCC1Cc2ccccc2)c3nc4ccccc4s3 2230a_100000748602_100000198972 [0,0,0,1,0,1|1,1,0]=4 230 B28R4.41200011 O=C(CN1CCCCC1Cc2ccccc2)c3nc4ccccc4s3 269982a_100000748602_100000198972 [0,0,0,1,0,1|1,1,0]=4 231 B28R4.41252118 O=C(CN1CCCC1CCc2ccccc2)c3cc4ccccc4o3 269982a_100000741814_100000209828 [0,0,0,1,0,1|2,0,0]=4 232 B28R4.41252118 O=C(CN1CCCC1CCc2ccccc2)c3nc4ccccc4s3 2230a_100000741814_100000198972 [0,0,0,1,0,1|1,1,0]=4 233 B28R4.41252118 O=C(CN1CCCC1CCc2ccccc2)c3nc4ccccc4s3 269982a_100000741814_100000198972 [0,0,0,1,0,1|1,1,0]=4 234 B28R4.5338240 O=C(Cc1nc2ccccc2o1)C3CCCCN3Cc4ccccc4 1458a_100000759619_100000195508 [0,0,0,1,0,1|2,0,0]=4 235 B28R4.5338240 O=C(Cc1nc2ncccc2o1)C3CCCCN3Cc4ccccc4 1458a_100000759619_100000696355 [0,0,0,1,0,1|1,0,0]=3 236 B28R4.5338240 O=C(Cc1nc2ncccc2o1)C3COCCN3Cc4ccccc4 1458a_100025773098_100000696355 [0,0,0,1,0,1|2,0,0]=4 237 B28R4.5338368 O=C(Cc1nc2ccccc2o1)C[C@H]3CCCN3Cc4ccccc4 1458a_100015185861_100015185826 [0,0,0,1,0,1|2,0,0]=4 238 B24R2.206131 Cc1cccnc1CC(=O)CCCCCCCc2ccccc2 1458a_200000034917_100000696600 [0,0,1,0,1,0|1,0,1]=4 239 B24R2.206131 Cc1cccnc1CC(=O)CCCCCCCc2ccccc2 1458a_200000722269_200009813472 [0,0,1,0,1,0|1,0,1]=4 240 B24R2.206131 Cc1ncccc1CC(=O)CCCCCCCc2ccccc2 1458a_200000034917_100000732876 [0,0,1,0,1,0|1,0,1]=4 241 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ccccc2O 1458a_100000743006_200009813472 [0,0,1,0,1,0|1,0,1]=4 242 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2cccnc2Br 1458a_200000034917_100010140945 [0,0,1,0,1,0|1,0,1]=4 243 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2cccnc2Cl 1458a_100000093521_200009813472 [0,0,1,0,1,0|1,0,1]=4 244 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2cccnc2Cl 1458a_200000034917_100000045678 [0,0,1,0,1,0|1,0,1]=4 245 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2cccnc2F 1458a_200000034917_100000099810 [0,0,1,0,1,0|1,0,1]=4 246 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2Br 1458a_200000034917_100025702911 [0,0,1,0,1,0|1,0,1]=4 247 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2Br 1458a_200012357574_200009813472 [0,0,1,0,1,0|1,0,1]=4 248 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2Cl 1458a_100011998755_200009813472 [0,0,1,0,1,0|1,0,1]=4 249 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2Cl 1458a_200000034917_100000099807 [0,0,1,0,1,0|1,0,1]=4 250 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2F 1458a_200000034917_100000104219 [0,0,1,0,1,0|1,0,1]=4 251 B24R2.206131 O=C(CCCCCCCc1ccccc1)Cc2ncccc2O 1458a_200000034917_200020655725 [0,0,1,0,1,0|0,0,1]=3 252 B24R2.206131 O=C(CCCCCCCc1ccccc1)Nc2ccccc2O 22a_100000185747_200000034917 [0,0,1,0,1,0|1,0,1]=4 253 B24R2.206131 O=C(CCCCCCCc1ccccc1)Nc2ccccc2O 527a_100000185747_200000034917 [0,0,1,0,1,0|1,0,1]=4 254 B24R2.206495 O=C(C=Cc1ccccc1O)CCCCCCc2ccccc2 1458a_100016263591_100011218729 [0,0,1,0,1,0|2,0,0]=4 255 B24R2.605735 C/C(=C\c1ccccn1)/C(=O)CCCCCCc2ccccc2 1458a_100025712827_100011218729 [0,0,1,0,1,0|2,0,0]=4 256 B24R2.605735 O=C(CCCCCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100011218729 [0,0,1,0,1,0|2,0,0]=4 257 B24R2.605965 C=C(C(=O)CCCCCCCc1ccccc1)c2ccccc2 1458a_100000065200_200009813472 [0,0,1,0,1,0|2,0,0]=4 258 B24R2.605965 CC(C(=O)CCCCCCCc1ccccc1)c2ccccn2 1458a_100000722050_200009813472 [0,0,1,0,1,0|1,0,1]=4 259 B24R2.605965 O=C(CCCCCCCc1ccccc1)[C@H](O)c2ccccc2 1458a_100000684486_200009813472 [0,0,1,0,1,0|1,0,1]=4 260 B24R3.5034911 c1ccc(cc1)CCCCCNCc2cc3ncccc3o2 207a_100000750932_100000104172 [1,0,0,0,1,0|2,0,0]=4 261 B24R3.5034911 c1ccc(cc1)CCCCCNCc2cc3ncccc3o2 270004a_100000750932_100000104172 [1,0,0,0,1,0|2,0,0]=4 262 B24R3.5034911 c1ccc(cc1)CCCCCNCc2nc3ccccc3o2 2230a_100000750932_100000195508 [1,0,0,0,1,0|2,0,0]=4 263 B24R3.5034911 c1ccc(cc1)CCCCCNCc2nc3ccccc3o2 34a_100000750932_200012361514 [1,0,0,0,1,0|2,0,0]=4 264 B24R3.5034911 c1ccc(cc1)CCCCCNCc2nc3ncccc3o2 2230a_100000750932_100000696355 [1,0,0,0,1,0|1,0,0]=3 265 B24R3.5034911 c1ccc(cc1)CCCCCOCc2nc3ccccc3o2 34a_200011219639_200012361514 [1,0,0,0,1,0|2,0,0]=4 266 B24R3.5034911 c1ccc(cc1)CCCCCOCc2nc3ccccc3o2 7a_200011219639_100000195508 [1,0,0,0,1,0|2,0,0]=4 267 B24R3.5034911 c1ccc(cc1)CCCCCOCc2nc3ncccc3o2 7a_200011219639_100000696355 [1,0,0,0,1,0|1,0,0]=3 268 B24R3.5034911 c1ccc(cc1)CCCCCSCc2nc3ccccc3o2 62a_200011217138_100000195508 [1,0,0,0,1,0|2,0,0]=4 269 B24R3.5034911 c1ccc(cc1)CCCCCSCc2nc3ncccc3o2 62a_200011217138_100000696355 [1,0,0,0,1,0|1,0,0]=3 270 B24R3.5034911 c1ccc(cc1)COCCCNCc2nc3ncccc3o2 2230a_200000206031_100000696355 [1,0,0,0,1,0|2,0,0]=4 271 B24R3.5034911 c1ccc(cc1)COCCCOCc2nc3ncccc3o2 7a_100000691849_100000696355 [1,0,0,0,1,0|2,0,0]=4 272 B24R3.5034911 c1ccc(cc1)COCCCSCc2nc3ncccc3o2 62a_100011215529_100000696355 [1,0,0,0,1,0|2,0,0]=4 273 B24R3.5034911 c1ccc(cc1)OCCCCOCc2nc3ncccc3o2 7a_100000752354_100000696355 [1,0,0,0,1,0|2,0,0]=4 274 B24R3.5034911 c1ccc(cc1)OCCCCSCc2nc3ncccc3o2 62a_100011215240_100000696355 [1,0,0,0,1,0|2,0,0]=4 275 B26R2.209913 O=C(C=Cc1ccccc1O)CCCCCCCCc2ccccc2 1458a_100016263591_100009814296 [0,0,1,0,0,1|2,0,0]=4 276 B26R2.209913 O=C(C=Cc1ccccc1O)CCCCCCOCc2ccccc2 1458a_100016263591_100012047231 [0,0,1,0,0,1|2,0,0]=4 277 B26R2.850327 C/C(=C\c1ccccn1)/C(=O)CCCCCCOCc2ccccc2 1458a_100025712827_100012047231 [0,0,1,0,0,1|2,0,0]=4 278 B26R2.850327 O=C(CCCCCCCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100009814296 [0,0,1,0,0,1|2,0,0]=4 279 B26R2.850327 O=C(CCCCCCOCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100012047231 [0,0,1,0,0,1|2,0,0]=4 280 B26R2.851510 O=C(CCCCCCCc1ccccc1)CC(=O)Nc2ccccn2 1458a_200000034917_100020662008 [0,0,1,0,0,1|0,0,2]=4 281 B26R2.851510 O=C(CCCCCCCc1ccccc1)CC(=O)Oc2ccccc2 1458a_200000034917_100009813826 [0,0,1,0,0,1|2,0,0]=4 282 B26R3.7523592 c1ccc(cc1)CCCCCCCSc2ccc3cccnc3n2 62a_100000075685_200009813472 [1,0,0,0,0,1|2,0,0]=4 283 B26R3.7523592 c1ccc(cc1)CCCCCCCSc2cnc3cccnc3n2 62a_200010275043_200009813472 [1,0,0,0,0,1|2,0,0]=4 284 B26R3.7523592 c1ccc(cc1)CCCCCCCSc2cnc3ncccc3n2 62a_100000084304_200009813472 [1,0,0,0,0,1|2,0,0]=4 285 B26R3.7523592 c1ccc(cc1)CCCCCCCSc2ncc3cccnc3n2 62a_100009875485_200009813472 [1,0,0,0,0,1|2,0,0]=4 286 B26R3.7523930 c1ccc(cc1)CCCCCCCOCc2nc3ccccc3o2 34a_100000042756_200012361514 [1,0,0,0,0,1|1,0,1]=4 287 B26R3.7523930 c1ccc(cc1)CCCCCCCOCc2nc3ccccc3o2 7a_100000042756_100000195508 [1,0,0,0,0,1|1,0,1]=4 288 B26R3.7523930 c1ccc(cc1)CCCCCCCOCc2nc3ncccc3o2 7a_100000042756_100000696355 [1,0,0,0,0,1|0,0,1]=3 289 B26R3.7523930 c1ccc(cc1)COCCCCCOCc2nc3ncccc3o2 7a_100011215045_100000696355 [1,0,0,0,0,1|1,0,1]=4 290 B26R3.7523930 c1ccc(cc1)COCCCCCSCc2nc3ncccc3o2 62a_100012032903_100000696355 [1,0,0,0,0,1|1,0,1]=4 291 B26R3.4549812 O=C(CCCCCCc1ccccc1)C2=Cc3ccccc3OC2 1458a_100000018039_100011218729 [0,0,0,0,1,1|2,0,0]=4 292 B26R3.4549812 O=C(CCCCCCc1ccccc1)c2ccc3cccnc3c2 1458a_100011933907_100011218729 [0,0,0,0,1,1|2,0,0]=4 293 B26R3.4549812 O=C(CCCCCCc1ccccc1)c2ccc3ncccc3c2 1458a_100011216044_100011218729 [0,0,0,0,1,1|2,0,0]=4 294 B28R3.5993334 O=C(CCCCCCOCc1ccccc1)C2=Cc3ccccc3OC2 1458a_100000018039_100012047231 [0,0,0,0,0,2|2,0,0]=4 295 B28R3.5993334 O=C(CCCCCCOCc1ccccc1)c2ccc3cccnc3c2 1458a_100011933907_100012047231 [0,0,0,0,0,2|2,0,0]=4 296 B28R3.5993334 O=C(CCCCCCOCc1ccccc1)c2ccc3ncccc3c2 1458a_100011216044_100012047231 [0,0,0,0,0,2|2,0,0]=4 297 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2cc3ccccc3cn2 1458a_200000034917_100009869231 [0,0,0,0,0,2|2,0,0]=4 298 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2ccc3ccccc3n2 1458a_200000034917_100000737579 [0,0,0,0,0,2|2,0,0]=4 299 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2ccc3ncccc3c2 1458a_100011218584_200009813472 [0,0,0,0,0,2|2,0,0]=4 300 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2ccc3ncccc3c2 1458a_200000034917_100000703657 [0,0,0,0,0,2|2,0,0]=4 301 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2cnc3ccccc3n2 1458a_200000034917_200000751123 [0,0,0,0,0,2|2,0,0]=4 302 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Cc2ncc3ccccc3n2 1458a_200000034917_100009868571 [0,0,0,0,0,2|2,0,0]=4 303 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3cccnc3c2 11a_100102887122_200000034917 [0,0,0,0,0,2|2,0,0]=4 304 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3cccnc3c2 1626a_100102887122_200000034917 [0,0,0,0,0,2|2,0,0]=4 305 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3cccnc3c2 22a_100102887122_200000034917 [0,0,0,0,0,2|2,0,0]=4 306 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3cccnc3c2 527a_100102887122_200000034917 [0,0,0,0,0,2|2,0,0]=4 307 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3ncccc3c2 11a_100011198106_200000034917 [0,0,0,0,0,2|2,0,0]=4 308 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3ncccc3c2 1626a_100011198106_200000034917 [0,0,0,0,0,2|2,0,0]=4 309 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3ncccc3c2 22a_100011198106_200000034917 [0,0,0,0,0,2|2,0,0]=4 310 B28R3.61188928 O=C(CCCCCCCc1ccccc1)Nc2ccc3ncccc3c2 527a_100011198106_200000034917 [0,0,0,0,0,2|2,0,0]=4 311 B28R3.61045536 O=C(CCCCCCCCc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_100009814296 [0,0,0,0,0,2|1,0,0]=3 312 B28R3.61045536 O=C(CCCCCCOCc1ccccc1)Cc2cc3ccccc3o2 1458a_100000735538_100012047231 [0,0,0,0,0,2|2,0,0]=4 313 B28R3.61045536 O=C(CCCCCCOCc1ccccc1)Cc2nc3ccccc3o2 1458a_100015185861_100012047231 [0,0,0,0,0,2|1,0,0]=3 314 B28R3.61045536 O=C(CCNCCCCCc1ccccc1)Nc2nc3ccccc3s2 2230a_100000750932_200011213626 [0,0,0,0,0,2|1,1,0]=4 315 B28R3.61045536 O=C(CCOCCCCCc1ccccc1)Nc2nc3ccccc3s2 7a_200011219639_200011213626 [0,0,0,0,0,2|1,1,0]=4 316 B28R3.61045536 O=C(COCCCCCCc1ccccc1)Nc2nc3ccccc3s2 7a_100011215581_100000752643 [0,0,0,0,0,2|1,1,0]=4 317 B28R3.119547728 O=C(CSCCCCCCOc1ccccc1)c2nc3ccccc3s2 62a_100000198972_200012047174 [0,0,0,0,0,2|1,1,0]=4 318 B28R3.119547728 O=C(CSCCCCCOCc1ccccc1)c2cc3ccccc3o2 62a_100012032903_100000209828 [0,0,0,0,0,2|2,0,0]=4 319 B28R3.119547728 O=C(CSCCCCCOCc1ccccc1)c2nc3ccccc3s2 62a_100000198972_100012032903 [0,0,0,0,0,2|1,1,0]=4 320 B28R3.61187825 O=C(C=Cc1nc2ccccc2o1)CCCCCCCc3ccccc3 1458a_100000697878_200009813472 [0,0,0,0,0,2|1,0,0]=3 321 B28R3.61187825 O=C(C=Cc1nc2ccccc2o1)CCCCCCOc3ccccc3 1458a_100000697878_200012047174 [0,0,0,0,0,2|2,0,0]=4 322 B28R3.61187825 O=C(C=Cc1nc2ccccc2o1)CCCCCOCc3ccccc3 1458a_100000697878_100012032903 [0,0,0,0,0,2|2,0,0]=4 323 B28R3.61187825 O=C(CCCCCCCc1ccccc1)CCc2nc3ccccc3[nH]2 1458a_100102526157_200009813472 [0,0,0,0,0,2|2,0,0]=4 324 B28R3.61187825 O=C(CCCCCCCc1ccccc1)CSc2nc3ccccc3[nH]2 1458a_100000179484_200009813472 [0,0,0,0,0,2|2,0,0]=4 325 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cc3ccccc3o2 11a_100011220112_200000034917 [0,0,0,0,0,2|2,0,0]=4 326 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cc3ccccc3o2 1626a_100011220112_200000034917 [0,0,0,0,0,2|2,0,0]=4 327 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cc3ccccc3o2 240690a_100011220112_200000034917 [0,0,0,0,0,2|2,0,0]=4 328 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cc3ccccc3o2 527a_100011220112_200000034917 [0,0,0,0,0,2|2,0,0]=4 329 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cn3cccnc3n2 11a_100025705072_200000034917 [0,0,0,0,0,2|2,0,0]=4 330 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cn3cccnc3n2 1626a_100025705072_200000034917 [0,0,0,0,0,2|2,0,0]=4 331 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cn3cccnc3n2 240690a_100025705072_200000034917 [0,0,0,0,0,2|2,0,0]=4 332 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2cn3cccnc3n2 527a_100025705072_200000034917 [0,0,0,0,0,2|2,0,0]=4 333 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3[nH]2 240690a_100000729406_200000034917 [0,0,0,0,0,2|2,0,0]=4 334 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3[nH]2 527a_100000729406_200000034917 [0,0,0,0,0,2|2,0,0]=4 335 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3o2 11a_100000733820_200000034917 [0,0,0,0,0,2|1,0,0]=3 336 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3o2 1626a_100000733820_200000034917 [0,0,0,0,0,2|1,0,0]=3 337 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3o2 240690a_100000733820_200000034917 [0,0,0,0,0,2|1,0,0]=3 338 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3o2 527a_100000733820_200000034917 [0,0,0,0,0,2|1,0,0]=3 339 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3s2 11a_100000174905_200000034917 [0,0,0,0,0,2|1,1,0]=4 340 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3s2 1626a_100000174905_200000034917 [0,0,0,0,0,2|1,1,0]=4 341 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3s2 240690a_100000174905_200000034917 [0,0,0,0,0,2|1,1,0]=4 342 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NCc2nc3ccccc3s2 527a_100000174905_200000034917 [0,0,0,0,0,2|1,1,0]=4 343 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NNc2nc3ccccc3[nH]2 22a_100000188875_200000034917 [0,0,0,0,0,2|2,0,0]=4 344 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NNc2nc3ccccc3o2 22a_100000182307_200000034917 [0,0,0,0,0,2|1,0,0]=3 345 B28R3.61187825 O=C(CCCCCCCc1ccccc1)NNc2nc3ccccc3s2 22a_100000181811_200000034917 [0,0,0,0,0,2|1,1,0]=4 346 B28R3.61187825 O=C(CCCCCCOc1ccccc1)CSc2nc3ccccc3o2 1458a_200000179485_200012047174 [0,0,0,0,0,2|2,0,0]=4 347 B28R3.61187825 O=C(CCCCCOCc1ccccc1)CSc2nc3ccccc3o2 1458a_200000179485_100012032903 [0,0,0,0,0,2|2,0,0]=4