0 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT0919 [0,0,1,0,0,0|3,0,0]=4 1 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT1115 [0,0,1,0,0,0|3,0,0]=4 2 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT2957 [0,0,1,0,0,0|3,0,0]=4 3 B15R2.21 O=Cc1ccccc1c2ccccn2 WXVL_QS0019BT0164 [0,0,1,0,0,0|2,0,0]=3 4 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT0919 [0,0,1,0,0,0|2,0,0]=3 5 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT1115 [0,0,1,0,0,0|2,0,0]=3 6 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT2957 [0,0,1,0,0,0|2,0,0]=3 7 B15R2.21 O=Cc1cccnc1c2ccccn2 WXVL_QS0466BT0164 [0,0,1,0,0,0|1,0,0]=2 8 B15R2.21 O=Cc1cccnc1c2cccnc2 WXVL_QS0466BT1208 [0,0,1,0,0,0|3,0,0]=4 9 B15R2.21 O=Cc1cccnc1c2cccnc2 WXVL_QS0466BT3912 [0,0,1,0,0,0|3,0,0]=4 10 B15R2.21 O=Cc1cccnc1c2ccncc2 WXVL_QS0466BT0574 [0,0,1,0,0,0|3,0,0]=4 11 B15R2.21 O=Cc1ccncc1c2ccccn2 WXVL_QS0453BT0164 [0,0,1,0,0,0|3,0,0]=4 12 B15R2.21 O=Cc1ncccc1c2ccccn2 WXVL_QS1727BT0164 [0,0,1,0,0,0|3,0,0]=4 13 B16R2.15 Cc1ccc(c(c1)C=O)c2ccccn2 WXVL_QS0394BT0164 [0,1,1,0,0,0|2,0,0]=4 14 B16R2.15 O=Cc1cc(ccc1c2ccccn2)Cl WXVL_QS0419BT0164 [0,1,1,0,0,0|2,0,0]=4 15 B16R2.15 O=Cc1cc(ccc1c2ccccn2)F WXVL_QS0188BT0164 [0,1,1,0,0,0|2,0,0]=4 16 B16R2.15 O=Cc1cc(ccc1c2ccccn2)I WXVL_QS1861BT0164 [0,1,1,0,0,0|2,0,0]=4 17 B16R2.15 O=Cc1cc(ccc1c2ccccn2)O WXVL_QS0527BT0164 [0,1,1,0,0,0|2,0,0]=4 18 B16R2.15 O=Cc1cc(cnc1c2ccccc2)Cl WXVL_QS1912BT0919 [0,1,1,0,0,0|2,0,0]=4 19 B16R2.15 O=Cc1cc(cnc1c2ccccc2)Cl WXVL_QS1912BT1115 [0,1,1,0,0,0|2,0,0]=4 20 B16R2.15 O=Cc1cc(cnc1c2ccccc2)Cl WXVL_QS1912BT2957 [0,1,1,0,0,0|2,0,0]=4 21 B16R2.15 O=Cc1cc(cnc1c2ccccn2)Cl WXVL_QS1912BT0164 [0,1,1,0,0,0|1,0,0]=3 22 B16R2.26 Cc1ccc(cc1)c2ncccc2C=O WXVL_QS0466BT1573 [0,1,1,0,0,0|2,0,0]=4 23 B16R2.26 Cc1ccc(cc1)c2ncccc2C=O WXVL_QS0466BT3934 [0,1,1,0,0,0|2,0,0]=4 24 B16R2.26 O=Cc1ccccc1c2ccc(cn2)F WXVL_QS0019BT0922 [0,1,1,0,0,0|2,0,0]=4 25 B16R2.26 O=Cc1cccnc1c2ccc(cc2)F WXVL_QS0466BT0486 [0,1,1,0,0,0|2,0,0]=4 26 B16R2.26 O=Cc1cccnc1c2ccc(cc2)F WXVL_QS0466BT0698 [0,1,1,0,0,0|2,0,0]=4 27 B16R2.26 O=Cc1cccnc1c2ccc(cc2)F WXVL_QS0466BT2075 [0,1,1,0,0,0|2,0,0]=4 28 B16R2.26 O=Cc1cccnc1c2ccc(cc2)I WXVL_QS0466BT1574 [0,1,1,0,0,0|2,0,0]=4 29 B16R2.26 O=Cc1cccnc1c2ccc(cc2)O WXVL_QS0466BT0555 [0,1,1,0,0,0|2,0,0]=4 30 B16R2.26 O=Cc1cccnc1c2ccc(cc2)O WXVL_QS0466BT0699 [0,1,1,0,0,0|2,0,0]=4 31 B16R2.26 O=Cc1cccnc1c2ccc(cc2)O WXVL_QS0466BT2080 [0,1,1,0,0,0|2,0,0]=4 32 B16R2.26 O=Cc1cccnc1c2ccc(cc2)O WXVL_QS0466BT4830 [0,1,1,0,0,0|2,0,0]=4 33 B16R2.26 O=Cc1cccnc1c2ccc(cc2)O WXVL_QS0466BT7243 [0,1,1,0,0,0|2,0,0]=4 34 B16R2.26 O=Cc1cccnc1c2ccc(cn2)F WXVL_QS0466BT0922 [0,1,1,0,0,0|1,0,0]=3 35 B16R2.87 NC(=O)c1cccnc1c2ccccc2 WXVL_AK0084SC0253 [0,1,1,0,0,0|2,0,0]=4 36 B16R2.87 NC(=O)c1cccnc1c2ccccc2 WXVL_AK0084SC0253 [0,1,1,0,0,0|2,0,0]=4 37 B16R2.1512 Cc1cccc(c1c2ccccn2)C=O WXVL_QS1205BT0164 [0,1,1,0,0,0|2,0,0]=4 38 B16R2.1512 O=Cc1cccc(c1c2ccccn2)Cl WXVL_QS0444BT0164 [0,1,1,0,0,0|2,0,0]=4 39 B16R2.1512 O=Cc1cccc(c1c2ccccn2)F WXVL_QS0458BT0164 [0,1,1,0,0,0|2,0,0]=4 40 B16R2.1512 O=Cc1cccc(c1c2ccccn2)O WXVL_QS1086BT0164 [0,1,1,0,0,0|2,0,0]=4 41 B16R2.2245 Cc1cccc(c1)c2ncccc2C=O WXVL_QS0466BT0798 [0,1,1,0,0,0|2,0,0]=4 42 B16R2.2245 Cc1cccc(c1)c2ncccc2C=O WXVL_QS0466BT9299 [0,1,1,0,0,0|2,0,0]=4 43 B16R2.2245 Cc1cccc(n1)c2ccccc2C=O WXVL_QS0019BT2168 [0,1,1,0,0,0|2,0,0]=4 44 B16R2.2245 Cc1cccc(n1)c2ncccc2C=O WXVL_QS0466BT2168 [0,1,1,0,0,0|1,0,0]=3 45 B16R2.2245 O=Cc1ccccc1c2cccc(n2)F WXVL_QS0019BT2106 [0,1,1,0,0,0|2,0,0]=4 46 B16R2.2245 O=Cc1ccccc1c2cccc(n2)F WXVL_QS0019BT4494 [0,1,1,0,0,0|2,0,0]=4 47 B16R2.2245 O=Cc1ccccc1c2cccc(n2)O WXVL_QS0019BT2413 [0,1,1,0,0,0|2,0,0]=4 48 B16R2.2245 O=Cc1cccnc1c2cccc(c2)F WXVL_QS0466BT1585 [0,1,1,0,0,0|2,0,0]=4 49 B16R2.2245 O=Cc1cccnc1c2cccc(c2)O WXVL_QS0466BT2076 [0,1,1,0,0,0|2,0,0]=4 50 B16R2.2245 O=Cc1cccnc1c2cccc(n2)F WXVL_QS0466BT2106 [0,1,1,0,0,0|1,0,0]=3 51 B16R2.2245 O=Cc1cccnc1c2cccc(n2)F WXVL_QS0466BT4494 [0,1,1,0,0,0|1,0,0]=3 52 B16R2.2245 O=Cc1cccnc1c2cccc(n2)O WXVL_QS0466BT2413 [0,1,1,0,0,0|1,0,0]=3 53 B16R2.2443 Cc1ccc(c(c1)c2ccccn2)C=O WXVL_QS0467BT0164 [0,1,1,0,0,0|2,0,0]=4 54 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT0919 [0,1,1,0,0,0|2,0,0]=4 55 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT1115 [0,1,1,0,0,0|2,0,0]=4 56 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT2957 [0,1,1,0,0,0|2,0,0]=4 57 B16R2.2443 Cc1ccc(c(n1)c2ccccn2)C=O WXVL_QS3039BT0164 [0,1,1,0,0,0|1,0,0]=3 58 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)Cl WXVL_QS1071BT0164 [0,1,1,0,0,0|2,0,0]=4 59 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)F WXVL_QS0426BT0164 [0,1,1,0,0,0|2,0,0]=4 60 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)I WXVL_QS1077BT0164 [0,1,1,0,0,0|2,0,0]=4 61 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)O WXVL_QS0348BT0164 [0,1,1,0,0,0|2,0,0]=4 62 B16R2.2474 Cc1ccccc1c2ncccc2C=O WXVL_QS0466BT1515 [0,1,1,0,0,0|2,0,0]=4 63 B16R2.2474 Cc1ccccc1c2ncccc2C=O WXVL_QS0466BT4142 [0,1,1,0,0,0|2,0,0]=4 64 B16R2.2474 Cc1ccccc1c2ncccc2C=O WXVL_QS0466BT9252 [0,1,1,0,0,0|2,0,0]=4 65 B16R2.2474 O=Cc1cccnc1c2ccccc2F WXVL_QS0466BT1435 [0,1,1,0,0,0|2,0,0]=4 66 B16R2.2474 O=Cc1cccnc1c2ccccc2F WXVL_QS0466BT1901 [0,1,1,0,0,0|2,0,0]=4 67 B16R2.2474 O=Cc1cccnc1c2ccccc2O WXVL_QS0466BT1646 [0,1,1,0,0,0|2,0,0]=4 68 B16R2.2602 Cc1cccc(c1C=O)c2ccccn2 WXVL_QS2957BT0164 [0,1,1,0,0,0|2,0,0]=4 69 B16R2.2602 O=Cc1c(cccc1c2ccccn2)Br WXVL_QS0858BT0164 [0,1,1,0,0,0|2,0,0]=4 70 B16R2.2602 O=Cc1c(cccc1c2ccccn2)Cl WXVL_QS0469BT0164 [0,1,1,0,0,0|2,0,0]=4 71 B16R2.2602 O=Cc1c(cccc1c2ccccn2)F WXVL_QS0407BT0164 [0,1,1,0,0,0|2,0,0]=4 72 B16R2.2602 O=Cc1c(cccc1c2ccccn2)O WXVL_QS0972BT0164 [0,1,1,0,0,0|2,0,0]=4 73 B16R2.2602 O=Cc1c(ccnc1c2ccccc2)Cl WXVL_QS5013BT0919 [0,1,1,0,0,0|2,0,0]=4 74 B16R2.2602 O=Cc1c(ccnc1c2ccccc2)Cl WXVL_QS5013BT1115 [0,1,1,0,0,0|2,0,0]=4 75 B16R2.2602 O=Cc1c(ccnc1c2ccccc2)Cl WXVL_QS5013BT2957 [0,1,1,0,0,0|2,0,0]=4 76 B16R2.2602 O=Cc1c(ccnc1c2ccccn2)Cl WXVL_QS5013BT0164 [0,1,1,0,0,0|1,0,0]=3 77 B16R2.88 O=C(Nc1ccccc1)c2cccnc2 WXVL_AG00183SC0061 [0,1,1,0,0,0|2,0,0]=4 78 B16R2.88 O=C(Nc1ccccc1)c2cccnc2 WXVL_AG00183SC0061 [0,1,1,0,0,0|2,0,0]=4 79 B16R2.88 O=C(Nc1cccnn1)c2cccnc2 WXVL_AF0151SC0061 [0,1,1,0,0,0|2,0,0]=4 80 B16R2.88 O=C(Nc1cccnn1)c2cccnc2 WXVL_AF0151SC0061 [0,1,1,0,0,0|2,0,0]=4 81 B16R2.88 O=C(Nc1ccnnc1)c2cccnc2 WXVL_AF0624SC0061 [0,1,1,0,0,0|2,0,0]=4 82 B16R2.88 O=C(Nc1ccnnc1)c2cccnc2 WXVL_AF0624SC0061 [0,1,1,0,0,0|2,0,0]=4 83 B16R2.88 O=C(Nc1cnccn1)c2cccnc2 WXVL_AF0120SC0061 [0,1,1,0,0,0|2,0,0]=4 84 B16R2.88 O=C(Nc1cnccn1)c2cccnc2 WXVL_AF0120SC0061 [0,1,1,0,0,0|2,0,0]=4 85 B16R2.88 O=C(Nc1cncnc1)c2cccnc2 WXVL_AF0085SC0061 [0,1,1,0,0,0|2,0,0]=4 86 B16R2.88 O=C(Nc1cncnc1)c2cccnc2 WXVL_AF0085SC0061 [0,1,1,0,0,0|2,0,0]=4 87 B14R2.14 O=Cc1ccsc1c2ccccn2 WXVL_QS2092BT0164 [0,0,1,0,1,0|2,0,0]=4 88 B14R2.14 O=Cc1cscc1c2ccccn2 WXVL_QS0787BT0164 [0,0,1,0,1,0|2,0,0]=4 89 B14R2.14 O=Cc1occc1c2ccccn2 WXVL_QS1403BT0164 [0,0,1,0,1,0|2,0,0]=4 90 B14R2.14 O=Cc1sccc1c2ccccn2 WXVL_QS0779BT0164 [0,0,1,0,1,0|2,0,0]=4 91 B14R2.98 C=Cc1ccccc1c2cccs2 WXVL_LR0498BT1736 [0,0,1,0,1,0|2,0,0]=4 92 B14R2.98 C=Cc1ccccc1c2ccon2 WXVL_LR0685BT1736 [0,0,1,0,1,0|2,0,0]=4 93 B14R2.98 O=Cc1cccnc1c2cc[nH]c2 WXVL_QS0466BT5115 [0,0,1,0,1,0|2,0,0]=4 94 B14R2.98 O=Cc1cccnc1c2cc[nH]n2 WXVL_QS0466BT0902 [0,0,1,0,1,0|2,0,0]=4 95 B14R2.98 O=Cc1cccnc1c2ccco2 WXVL_QS0466BT1995 [0,0,1,0,1,0|2,0,0]=4 96 B14R2.98 O=Cc1cccnc1c2cccs2 WXVL_QS0466BT1547 [0,0,1,0,1,0|2,0,0]=4 97 B14R2.98 O=Cc1cccnc1c2cccs2 WXVL_QS0466BT4023 [0,0,1,0,1,0|2,0,0]=4 98 B14R2.98 O=Cc1cccnc1c2cccs2 WXVL_QS0466BT5079 [0,0,1,0,1,0|2,0,0]=4 99 B14R2.98 O=Cc1cccnc1c2ccoc2 WXVL_QS0466BT1598 [0,0,1,0,1,0|2,0,0]=4 100 B14R2.98 O=Cc1cccnc1c2ccsc2 WXVL_QS0466BT1561 [0,0,1,0,1,0|2,0,0]=4 101 B14R2.98 O=Cc1cccnc1c2cscn2 WXVL_QS0466BT0962 [0,0,1,0,1,0|2,0,0]=4 102 B14R2.98 O=Cc1cccnc1c2nccs2 WXVL_QS0466BT2077 [0,0,1,0,1,0|2,0,0]=4 103 B16R2.172 C=Cc1ccccc1Nc2ccncn2 WXVL_AG2145LP3358 [0,0,1,0,0,1|2,0,0]=4 104 B16R2.172 C=Cc1ccccc1Nc2ccncn2 WXVL_AG2145LP3358 [0,0,1,0,0,1|2,0,0]=4 105 B16R2.172 C=Cc1ccccc1Nc2ncccn2 WXVL_AG2145LP0002 [0,0,1,0,0,1|2,0,0]=4 106 B16R2.172 C=Cc1ccccc1Nc2ncccn2 WXVL_AG2145LP0002 [0,0,1,0,0,1|2,0,0]=4