0 B22R3.1325097 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nn[nH]n3 WXVL_QS0394BT1463 [0,0,0,0,0,0|1,0,2]=3 1 B22R3.1325097 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nnco3 WXVL_QS0394BT5248 [0,0,0,0,0,0|3,0,0]=3 2 B22R3.1325097 Cc1ccc(c(c1)C=O)c2ccc(cc2)n3ccnn3 WXVL_QS0394BT1849 [0,0,0,0,0,0|4,0,0]=4 3 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3cccs3)Cl WXVL_QS0419BT0918 [0,0,0,0,0,0|4,0,0]=4 4 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS0419BT1463 [0,0,0,0,0,0|0,0,2]=2 5 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nn[nH]n3)F WXVL_QS0188BT1463 [0,0,0,0,0,0|0,1,2]=3 6 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nn[nH]n3)I WXVL_QS1861BT1463 [0,0,0,0,0,0|0,1,2]=3 7 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nn[nH]n3)O WXVL_QS0527BT1463 [0,0,0,0,0,0|1,0,2]=3 8 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nnco3)Cl WXVL_QS0419BT5248 [0,0,0,0,0,0|2,0,0]=2 9 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nnco3)F WXVL_QS0188BT5248 [0,0,0,0,0,0|2,1,0]=3 10 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nnco3)I WXVL_QS1861BT5248 [0,0,0,0,0,0|2,1,0]=3 11 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3nnco3)O WXVL_QS0527BT5248 [0,0,0,0,0,0|3,0,0]=3 12 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)n3cccn3)Cl WXVL_QS0419BT0741 [0,0,0,0,0,0|4,0,0]=4 13 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)n3ccnn3)Cl WXVL_QS0419BT1849 [0,0,0,0,0,0|3,0,0]=3 14 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)n3ccnn3)F WXVL_QS0188BT1849 [0,0,0,0,0,0|3,1,0]=4 15 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)n3ccnn3)I WXVL_QS1861BT1849 [0,0,0,0,0,0|3,1,0]=4 16 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)n3ccnn3)O WXVL_QS0527BT1849 [0,0,0,0,0,0|4,0,0]=4 17 B22R3.1325097 O=Cc1cc(cnc1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS1912BT1463 [0,0,0,0,0,0|1,0,2]=3 18 B22R3.1325097 O=Cc1cc(cnc1c2ccc(cc2)c3nnco3)Cl WXVL_QS1912BT5248 [0,0,0,0,0,0|3,0,0]=3 19 B22R3.1325097 O=Cc1cc(cnc1c2ccc(cc2)n3ccnn3)Cl WXVL_QS1912BT1849 [0,0,0,0,0,0|4,0,0]=4 20 B22R3.1325097 O=Cc1cc(ncc1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS0904BT1463 [0,0,0,0,0,0|1,0,2]=3 21 B22R3.1325097 O=Cc1cc(ncc1c2ccc(cc2)c3nn[nH]n3)O WXVL_QS4347BT1463 [0,0,0,0,0,0|2,0,2]=4 22 B22R3.1325097 O=Cc1cc(ncc1c2ccc(cc2)c3nnco3)Cl WXVL_QS0904BT5248 [0,0,0,0,0,0|3,0,0]=3 23 B22R3.1325097 O=Cc1cc(ncc1c2ccc(cc2)c3nnco3)O WXVL_QS4347BT5248 [0,0,0,0,0,0|4,0,0]=4 24 B22R3.1325097 O=Cc1cc(ncc1c2ccc(cc2)n3ccnn3)Cl WXVL_QS0904BT1849 [0,0,0,0,0,0|4,0,0]=4 25 B21R3.120 O=Cc1ccccc1c2ccc(cc2)c3nn[nH]n3 WXVL_QS0019BT1463 [1,0,0,0,0,0|0,0,2]=3 26 B21R3.120 O=Cc1ccccc1c2ccc(cc2)c3nnco3 WXVL_QS0019BT5248 [1,0,0,0,0,0|2,0,0]=3 27 B21R3.120 O=Cc1ccccc1c2ccc(cc2)n3ccnn3 WXVL_QS0019BT1849 [1,0,0,0,0,0|3,0,0]=4 28 B21R3.120 O=Cc1cccnc1c2ccc(cc2)c3nn[nH]n3 WXVL_QS0466BT1463 [1,0,0,0,0,0|1,0,2]=4 29 B21R3.120 O=Cc1cccnc1c2ccc(cc2)c3nnco3 WXVL_QS0466BT5248 [1,0,0,0,0,0|3,0,0]=4 30 B21R3.120 O=Cc1ccncc1c2ccc(cc2)c3nn[nH]n3 WXVL_QS0453BT1463 [1,0,0,0,0,0|1,0,2]=4 31 B21R3.120 O=Cc1ccncc1c2ccc(cc2)c3nnco3 WXVL_QS0453BT5248 [1,0,0,0,0,0|3,0,0]=4 32 B21R3.120 O=Cc1ncccc1c2ccc(cc2)c3nn[nH]n3 WXVL_QS1727BT1463 [1,0,0,0,0,0|1,0,2]=4 33 B21R3.120 O=Cc1ncccc1c2ccc(cc2)c3nnco3 WXVL_QS1727BT5248 [1,0,0,0,0,0|3,0,0]=4 34 B23R3.730 O=Cc1cc(cc(c1c2ccc(cc2)c3nn[nH]n3)F)F WXVL_QS5055BT1463 [0,1,0,0,0,0|0,1,2]=4 35 B23R3.730 O=Cc1cc(cc(c1c2ccc(cc2)c3nnco3)F)F WXVL_QS5055BT5248 [0,1,0,0,0,0|2,1,0]=4 36 B23R3.87538 COc1ccc(c(c1)C=O)c2ccc(cc2)c3nn[nH]n3 WXVL_QS0487BT1463 [0,1,0,0,0,0|1,0,2]=4 37 B23R3.87538 COc1ccc(c(c1)C=O)c2ccc(cc2)c3nnco3 WXVL_QS0487BT5248 [0,1,0,0,0,0|3,0,0]=4 38 B23R3.87538 N#Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nn[nH]n3 WXVL_QS1286BT1463 [0,1,0,0,0,0|1,0,2]=4 39 B23R3.87538 N#Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nnco3 WXVL_QS1286BT5248 [0,1,0,0,0,0|3,0,0]=4 40 B23R3.1597910 O=Cc1cc(c(cc1c2ccc(cc2)c3nn[nH]n3)F)F WXVL_QS1337BT1463 [0,1,0,0,0,0|0,1,2]=4 41 B23R3.1597910 O=Cc1cc(c(cc1c2ccc(cc2)c3nnco3)F)F WXVL_QS1337BT5248 [0,1,0,0,0,0|2,1,0]=4 42 B23R3.1787427 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nnc(o3)C WXVL_QS0394BT1421 [0,1,0,0,0,0|3,0,0]=4 43 B23R3.1787427 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nnc(o3)C WXVL_QS0394BT2675 [0,1,0,0,0,0|3,0,0]=4 44 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)Cl WXVL_QS0419BT1421 [0,1,0,0,0,0|2,0,0]=3 45 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)Cl WXVL_QS0419BT2675 [0,1,0,0,0,0|2,0,0]=3 46 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)F WXVL_QS0188BT1421 [0,1,0,0,0,0|2,1,0]=4 47 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)F WXVL_QS0188BT2675 [0,1,0,0,0,0|2,1,0]=4 48 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)I WXVL_QS1861BT1421 [0,1,0,0,0,0|2,1,0]=4 49 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)I WXVL_QS1861BT2675 [0,1,0,0,0,0|2,1,0]=4 50 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)O WXVL_QS0527BT1421 [0,1,0,0,0,0|3,0,0]=4 51 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)O WXVL_QS0527BT2675 [0,1,0,0,0,0|3,0,0]=4 52 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3cnc(cc3C=O)Cl WXVL_QS0904BT1421 [0,1,0,0,0,0|3,0,0]=4 53 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3cnc(cc3C=O)Cl WXVL_QS0904BT2675 [0,1,0,0,0,0|3,0,0]=4 54 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ncc(cc3C=O)Cl WXVL_QS1912BT1421 [0,1,0,0,0,0|3,0,0]=4 55 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ncc(cc3C=O)Cl WXVL_QS1912BT2675 [0,1,0,0,0,0|3,0,0]=4 56 B23R3.1787427 Cn1nnc(n1)c2ccc(cn2)c3ccc(cc3C=O)Cl WXVL_QS0419BT3495 [0,1,0,0,0,0|1,0,2]=4 57 B23R3.2177672 Cc1ccc(c(c1F)C=O)c2ccc(cc2)c3nn[nH]n3 WXVL_QS2237BT1463 [0,1,0,0,0,0|1,0,2]=4 58 B23R3.2177672 Cc1ccc(c(c1F)C=O)c2ccc(cc2)c3nnco3 WXVL_QS2237BT5248 [0,1,0,0,0,0|3,0,0]=4 59 B23R3.2177672 O=Cc1c(ccc(c1Cl)Cl)c2ccc(cc2)c3nn[nH]n3 WXVL_QS2723BT1463 [0,1,0,0,0,0|0,0,2]=3 60 B23R3.2177672 O=Cc1c(ccc(c1Cl)Cl)c2ccc(cc2)c3nnco3 WXVL_QS2723BT5248 [0,1,0,0,0,0|2,0,0]=3 61 B23R3.2177672 O=Cc1c(ccc(c1Cl)Cl)c2ccc(cc2)n3ccnn3 WXVL_QS2723BT1849 [0,1,0,0,0,0|3,0,0]=4 62 B23R3.2177672 O=Cc1c(ccc(c1F)Cl)c2ccc(cc2)c3nn[nH]n3 WXVL_QS1289BT1463 [0,1,0,0,0,0|0,0,2]=3 63 B23R3.2177672 O=Cc1c(ccc(c1F)Cl)c2ccc(cc2)c3nnco3 WXVL_QS1289BT5248 [0,1,0,0,0,0|2,0,0]=3 64 B23R3.2177672 O=Cc1c(ccc(c1F)Cl)c2ccc(cc2)n3ccnn3 WXVL_QS1289BT1849 [0,1,0,0,0,0|3,0,0]=4 65 B23R3.2177672 O=Cc1c(ccc(c1F)F)c2ccc(cc2)c3nn[nH]n3 WXVL_QS1420BT1463 [0,1,0,0,0,0|0,1,2]=4 66 B23R3.2177672 O=Cc1c(ccc(c1F)F)c2ccc(cc2)c3nnco3 WXVL_QS1420BT5248 [0,1,0,0,0,0|2,1,0]=4 67 B21R2.17182 CCNC(=O)c1ccc(cc1)c2ccc(cc2C=O)Cl WXVL_QS0419BT0811 [0,0,1,0,0,0|3,0,0]=4 68 B21R2.17182 CONC(=O)c1ccc(cc1)c2ccc(cc2C=O)Cl WXVL_QS0419BT3980 [0,0,1,0,0,0|3,0,0]=4 69 B21R2.17182 CONC(=O)c1ccc(cc1)c2ccc(cc2C=O)Cl WXVL_QS0419BT6144 [0,0,1,0,0,0|3,0,0]=4 70 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3ccccn3)Cl WXVL_QS0419BT0992 [0,0,0,0,0,1|3,0,0]=4 71 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3ccccn3)Cl WXVL_QS0419BT2124 [0,0,0,0,0,1|3,0,0]=4 72 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3cccnc3)Cl WXVL_QS0419BT0942 [0,0,0,0,0,1|3,0,0]=4 73 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3cccnc3)Cl WXVL_QS0419BT1660 [0,0,0,0,0,1|3,0,0]=4 74 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3ccncc3)Cl WXVL_QS0419BT1251 [0,0,0,0,0,1|3,0,0]=4 75 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3ccncc3)Cl WXVL_QS0419BT1657 [0,0,0,0,0,1|3,0,0]=4 76 B20R2.30455 CNC(=O)c1ccc(cc1)c2ccc(cc2C=O)Cl WXVL_QS0419BT1635 [1,0,1,0,0,0|2,0,0]=4 77 B20R2.30455 CNC(=O)c1ccc(cc1)c2ccc(cc2C=O)Cl WXVL_QS0419BT4797 [1,0,1,0,0,0|2,0,0]=4 78 B22R3.3860 Cc1ccc(c(c1)c2ccc(cc2)c3nn[nH]n3)C=O WXVL_QS0467BT1463 [1,1,0,0,0,0|0,0,2]=4 79 B22R3.3860 Cc1ccc(c(c1)c2ccc(cc2)c3nnco3)C=O WXVL_QS0467BT5248 [1,1,0,0,0,0|2,0,0]=4 80 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS1071BT1463 [1,1,0,0,0,0|0,0,2]=4 81 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nn[nH]n3)F WXVL_QS0426BT1463 [1,1,0,0,0,0|0,0,2]=4 82 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nn[nH]n3)I WXVL_QS1077BT1463 [1,1,0,0,0,0|0,0,2]=4 83 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nn[nH]n3)O WXVL_QS0348BT1463 [1,1,0,0,0,0|0,0,2]=4 84 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nnco3)Cl WXVL_QS1071BT5248 [1,1,0,0,0,0|2,0,0]=4 85 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nnco3)F WXVL_QS0426BT5248 [1,1,0,0,0,0|2,0,0]=4 86 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nnco3)I WXVL_QS1077BT5248 [1,1,0,0,0,0|2,0,0]=4 87 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3nnco3)O WXVL_QS0348BT5248 [1,1,0,0,0,0|2,0,0]=4 88 B22R3.5854 Cc1nnc(o1)c2ccc(cc2)c3ccccc3C=O WXVL_QS0019BT1421 [1,1,0,0,0,0|2,0,0]=4 89 B22R3.5854 Cc1nnc(o1)c2ccc(cc2)c3ccccc3C=O WXVL_QS0019BT2675 [1,1,0,0,0,0|2,0,0]=4 90 B22R3.59496 Cc1cccc(c1c2ccc(cc2)c3nn[nH]n3)C=O WXVL_QS1205BT1463 [1,1,0,0,0,0|0,0,2]=4 91 B22R3.59496 Cc1cccc(c1c2ccc(cc2)c3nnco3)C=O WXVL_QS1205BT5248 [1,1,0,0,0,0|2,0,0]=4 92 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS0444BT1463 [1,1,0,0,0,0|0,0,2]=4 93 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nn[nH]n3)F WXVL_QS0458BT1463 [1,1,0,0,0,0|0,0,2]=4 94 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nn[nH]n3)O WXVL_QS1086BT1463 [1,1,0,0,0,0|0,0,2]=4 95 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nnco3)Cl WXVL_QS0444BT5248 [1,1,0,0,0,0|2,0,0]=4 96 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nnco3)F WXVL_QS0458BT5248 [1,1,0,0,0,0|2,0,0]=4 97 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nnco3)O WXVL_QS1086BT5248 [1,1,0,0,0,0|2,0,0]=4 98 B22R3.143227 Cc1cccc(c1C=O)c2ccc(cc2)c3nn[nH]n3 WXVL_QS2957BT1463 [1,1,0,0,0,0|0,0,2]=4 99 B22R3.143227 Cc1cccc(c1C=O)c2ccc(cc2)c3nnco3 WXVL_QS2957BT5248 [1,1,0,0,0,0|2,0,0]=4 100 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nn[nH]n3)Br WXVL_QS0858BT1463 [1,1,0,0,0,0|0,0,2]=4 101 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS0469BT1463 [1,1,0,0,0,0|0,0,2]=4 102 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nn[nH]n3)F WXVL_QS0407BT1463 [1,1,0,0,0,0|0,0,2]=4 103 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nn[nH]n3)O WXVL_QS0972BT1463 [1,1,0,0,0,0|0,0,2]=4 104 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nnco3)Br WXVL_QS0858BT5248 [1,1,0,0,0,0|2,0,0]=4 105 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nnco3)Cl WXVL_QS0469BT5248 [1,1,0,0,0,0|2,0,0]=4 106 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nnco3)F WXVL_QS0407BT5248 [1,1,0,0,0,0|2,0,0]=4 107 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3nnco3)O WXVL_QS0972BT5248 [1,1,0,0,0,0|2,0,0]=4 108 B24R3.2324920 Cc1nnc(o1)c2ccc(cc2)c3ccc(c(c3C=O)Cl)Cl WXVL_QS2723BT1421 [0,2,0,0,0,0|2,0,0]=4 109 B24R3.2324920 Cc1nnc(o1)c2ccc(cc2)c3ccc(c(c3C=O)Cl)Cl WXVL_QS2723BT2675 [0,2,0,0,0,0|2,0,0]=4 110 B24R3.2324920 Cc1nnc(o1)c2ccc(cc2)c3ccc(c(c3C=O)F)Cl WXVL_QS1289BT1421 [0,2,0,0,0,0|2,0,0]=4 111 B24R3.2324920 Cc1nnc(o1)c2ccc(cc2)c3ccc(c(c3C=O)F)Cl WXVL_QS1289BT2675 [0,2,0,0,0,0|2,0,0]=4 112 B22R3.3359366 O=Cc1cc(ccc1c2ccc3c(ncnc3c2)O)Cl WXVL_QS0419BT0347 [0,0,1,1,0,0|2,0,0]=4 113 B22R3.4325 O=Cc1cc(ccc1c2cccc(c2)c3nn[nH]n3)Cl WXVL_QS0419BT2420 [0,0,0,0,1,1|0,0,2]=4 114 B22R3.90 O=Cc1cc(ccc1Cl)c2ccc(cc2)c3nn[nH]n3 WXVL_QS0472BT1463 [0,0,0,0,1,1|0,0,2]=4 115 B22R3.90 O=Cc1cc(ccc1Cl)c2ccc(cc2)c3nnco3 WXVL_QS0472BT5248 [0,0,0,0,1,1|2,0,0]=4 116 B22R3.702 O=Cc1cc(cc(c1)c2ccc(cc2)c3nn[nH]n3)Cl WXVL_QS1523BT1463 [0,0,0,0,1,1|0,0,2]=4 117 B22R3.702 O=Cc1cc(cc(c1)c2ccc(cc2)c3nnco3)Cl WXVL_QS1523BT5248 [0,0,0,0,1,1|2,0,0]=4