0 B22R3.10658 CN1CCC(C1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB1540 [1,0,0,0,0,0|1,0,1]=3 1 B22R3.10658 CN1CCC(C1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB1540 [1,0,0,0,0,0|1,0,1]=3 2 B22R3.10658 CN1CCC(C1)C(=O)Nc2nc(cs2)c3ccccc3 WXVL_AF2468SB1540 [1,0,0,0,0,0|2,0,1]=4 3 B22R3.10658 CN1CCC(C1)C(=O)Nc2nc(cs2)c3ccccc3 WXVL_AF2468SB1540 [1,0,0,0,0,0|2,0,1]=4 4 B22R3.10658 CN1CCC(C1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB1540 [1,0,0,0,0,0|0,1,1]=3 5 B22R3.10658 CN1CCC(C1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB1540 [1,0,0,0,0,0|0,1,1]=3 6 B22R3.10658 CN1CCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1540 [1,0,0,0,0,0|0,0,1]=2 7 B22R3.10658 CN1CCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1540 [1,0,0,0,0,0|0,0,1]=2 8 B22R3.10658 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB1540 [1,0,0,0,0,0|1,0,1]=3 9 B22R3.10658 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB1540 [1,0,0,0,0,0|1,0,1]=3 10 B22R3.10658 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccncc3 WXVL_AF2786SB1540 [1,0,0,0,0,0|2,0,1]=4 11 B22R3.10658 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccncc3 WXVL_AF2786SB1540 [1,0,0,0,0,0|2,0,1]=4 12 B22R3.10658 C[C@@H]1CC[C@@H](O1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0853 [1,0,0,0,0,0|2,0,1]=4 13 B22R3.10658 C[C@@H]1CC[C@@H](O1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0853 [1,0,0,0,0,0|2,0,1]=4 14 B22R3.10658 O=C(Nc1ncc(s1)c2ccccc2)[C@@H]3C[C@@H](CN3)O WXVL_AF0241SB00007 [1,0,0,0,0,0|3,0,0]=4 15 B22R3.10658 O=C(Nc1ncc(s1)c2ccccc2)[C@@H]3C[C@@H](CN3)O WXVL_AF0241SB00007 [1,0,0,0,0,0|3,0,0]=4 16 B22R3.10658 O=C1CC(CN1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0366 [1,0,0,0,0,0|3,0,0]=4 17 B22R3.10658 O=C1CC(CN1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0366 [1,0,0,0,0,0|3,0,0]=4 18 B22R3.10658 O=C1CC[C@H](N1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0126 [1,0,0,0,0,0|3,0,0]=4 19 B22R3.10658 O=C1CC[C@H](N1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0126 [1,0,0,0,0,0|3,0,0]=4 20 B22R2.25921 CCCCCC(C)C(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB0394 [0,0,1,0,0,0|2,0,1]=4 21 B22R2.25921 CCCCCC(C)C(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB0394 [0,0,1,0,0,0|2,0,1]=4 22 B24R4.4103583 O=C(Nc1ncc(s1)c2ccccc2)C3CC4C=CC3C4 WXVL_AF0241SB2411 [0,0,0,1,0,0|2,0,1]=4 23 B24R4.4103583 O=C(Nc1ncc(s1)c2ccccc2)C3CC4C=CC3C4 WXVL_AF0241SB2411 [0,0,0,1,0,0|2,0,1]=4 24 B22R3.4795 N#CC1CCN(C1)C(=O)c2ccc(s2)c3ccccc3 WXVL_AN00663SC0621 [0,0,0,0,1,0|3,0,0]=4 25 B24R3.2458 CCC1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1143 [0,0,0,0,0,1|2,0,1]=4 26 B24R3.2458 CCC1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1143 [0,0,0,0,0,1|2,0,1]=4 27 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB0755 [0,0,0,0,0,1|2,0,1]=4 28 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB0755 [0,0,0,0,0,1|2,0,1]=4 29 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB0755 [0,0,0,0,0,1|1,1,1]=4 30 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB0755 [0,0,0,0,0,1|1,1,1]=4 31 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0755 [0,0,0,0,0,1|1,0,1]=3 32 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0755 [0,0,0,0,0,1|1,0,1]=3 33 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB0755 [0,0,0,0,0,1|2,0,1]=4 34 B24R3.2458 CCN1CCC(CC1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB0755 [0,0,0,0,0,1|2,0,1]=4 35 B24R3.2458 CO[C@H]1CC[C@@H](CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB5407 [0,0,0,0,0,1|3,0,0]=4 36 B24R3.2458 CO[C@H]1CC[C@@H](CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB5407 [0,0,0,0,0,1|3,0,0]=4 37 B24R3.2458 O=C(Nc1ncc(s1)c2ccccc2)C3CCC(CC3)CO WXVL_AF0241SB1565 [0,0,0,0,0,1|2,0,1]=4 38 B24R3.2458 O=C(Nc1ncc(s1)c2ccccc2)C3CCC(CC3)CO WXVL_AF0241SB1565 [0,0,0,0,0,1|2,0,1]=4 39 B21R2.22435 CC(C)CCCC(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB1301 [1,0,1,0,0,0|1,0,1]=4 40 B21R2.22435 CC(C)CCCC(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB1301 [1,0,1,0,0,0|1,0,1]=4 41 B21R2.22435 CN(C)CCCC(=O)Nc1ccc(s1)c2ccccc2 WXVL_AF00245SB00055 [1,0,1,0,0,0|1,0,1]=4 42 B21R2.22435 CN(C)CCCC(=O)Nc1ccc(s1)c2ccccc2 WXVL_AF00245SB00055 [1,0,1,0,0,0|1,0,1]=4 43 B21R2.22435 CN(C)CCCC(=O)Nc1ncc(o1)c2ccccc2 WXVL_AF5259SB00055 [1,0,1,0,0,0|0,1,1]=4 44 B21R2.22435 CN(C)CCCC(=O)Nc1ncc(o1)c2ccccc2 WXVL_AF5259SB00055 [1,0,1,0,0,0|0,1,1]=4 45 B21R2.22435 CN(C)CCCC(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB00055 [1,0,1,0,0,0|0,0,1]=3 46 B21R2.22435 CN(C)CCCC(=O)Nc1ncc(s1)c2ccccc2 WXVL_AF0241SB00055 [1,0,1,0,0,0|0,0,1]=3 47 B21R2.22435 CN(C)CCCC(=O)Nc1nnc(s1)c2ccccc2 WXVL_AF2688SB00055 [1,0,1,0,0,0|1,0,1]=4 48 B21R2.22435 CN(C)CCCC(=O)Nc1nnc(s1)c2ccccc2 WXVL_AF2688SB00055 [1,0,1,0,0,0|1,0,1]=4 49 B21R3.625 O=C(Nc1ccc(s1)c2ccccc2)C3CCCC3 WXVL_AF00245SB0043 [2,0,0,0,0,0|2,0,0]=4 50 B21R3.625 O=C(Nc1ccc(s1)c2ccccc2)C3CCCC3 WXVL_AF00245SB0043 [2,0,0,0,0,0|2,0,0]=4 51 B21R3.625 O=C(Nc1ncc(o1)c2ccccc2)C3CCCC3 WXVL_AF5259SB0043 [2,0,0,0,0,0|1,1,0]=4 52 B21R3.625 O=C(Nc1ncc(o1)c2ccccc2)C3CCCC3 WXVL_AF5259SB0043 [2,0,0,0,0,0|1,1,0]=4 53 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCC3 WXVL_AF0241SB0043 [2,0,0,0,0,0|1,0,0]=3 54 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCC3 WXVL_AF0241SB0043 [2,0,0,0,0,0|1,0,0]=3 55 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCO3 WXVL_AF0241SB1033 [2,0,0,0,0,0|2,0,0]=4 56 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCO3 WXVL_AF0241SB1033 [2,0,0,0,0,0|2,0,0]=4 57 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCS3 WXVL_AF0241SB0022 [2,0,0,0,0,0|2,0,0]=4 58 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)C3CCCS3 WXVL_AF0241SB0022 [2,0,0,0,0,0|2,0,0]=4 59 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3CCCO3 WXVL_AF0241SB00043 [2,0,0,0,0,0|2,0,0]=4 60 B21R3.625 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3CCCO3 WXVL_AF0241SB00043 [2,0,0,0,0,0|2,0,0]=4 61 B21R3.625 O=C(Nc1nnc(s1)c2ccccc2)C3CCCC3 WXVL_AF2688SB0043 [2,0,0,0,0,0|2,0,0]=4 62 B21R3.625 O=C(Nc1nnc(s1)c2ccccc2)C3CCCC3 WXVL_AF2688SB0043 [2,0,0,0,0,0|2,0,0]=4 63 B23R3.51028 O=C(Nc1ncc(s1)c2ccccc2)C3CCC(C3)(F)F WXVL_AF0241SB0803 [1,1,0,0,0,0|2,0,0]=4 64 B23R3.51028 O=C(Nc1ncc(s1)c2ccccc2)C3CCC(C3)(F)F WXVL_AF0241SB0803 [1,1,0,0,0,0|2,0,0]=4 65 B23R3.112159 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccccc3Cl WXVL_AF2844SB1540 [1,1,0,0,0,0|1,0,1]=4 66 B23R3.112159 CN1CCC(C1)C(=O)Nc2nnc(s2)c3ccccc3Cl WXVL_AF2844SB1540 [1,1,0,0,0,0|1,0,1]=4 67 B23R3.120024 Cc1ccc(cc1)c2nnc(s2)NC(=O)C3CCN(C3)C WXVL_AF2780SB1540 [1,1,0,0,0,0|1,0,1]=4 68 B23R3.120024 Cc1ccc(cc1)c2nnc(s2)NC(=O)C3CCN(C3)C WXVL_AF2780SB1540 [1,1,0,0,0,0|1,0,1]=4 69 B25R3.80868 CC(=O)N1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0148 [0,1,0,0,0,1|1,0,1]=4 70 B25R3.80868 CC(=O)N1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0148 [0,1,0,0,0,1|1,0,1]=4 71 B25R3.80868 CC(C)N1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1495 [0,1,0,0,0,1|1,0,1]=4 72 B25R3.80868 CC(C)N1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1495 [0,1,0,0,0,1|1,0,1]=4 73 B23R3.1958160 O=C(CCN1CCCC1)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0766 [0,0,1,1,0,0|1,0,1]=4 74 B23R3.1958160 O=C(CCN1CCCC1)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0766 [0,0,1,1,0,0|1,0,1]=4 75 B23R3.44036 CN1CCCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SA00108 [0,0,1,1,0,0|1,0,1]=4 76 B23R3.44036 CN1CCCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SA00108 [0,0,1,1,0,0|1,0,1]=4 77 B23R3.44036 CN1CCCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1435 [0,0,1,1,0,0|1,0,1]=4 78 B23R3.44036 CN1CCCC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB1435 [0,0,1,1,0,0|1,0,1]=4 79 B23R3.1407 CN1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB00008 [0,0,1,1,0,0|1,0,1]=4 80 B23R3.1407 CN1CCC(CC1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB00008 [0,0,1,1,0,0|1,0,1]=4 81 B21R3.12775 C=C1CC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0804 [1,0,0,0,1,0|1,0,1]=4 82 B21R3.12775 C=C1CC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0804 [1,0,0,0,1,0|1,0,1]=4 83 B21R3.12775 CN1CC(C1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB0021 [1,0,0,0,1,0|1,0,1]=4 84 B21R3.12775 CN1CC(C1)C(=O)Nc2ccc(s2)c3ccccc3 WXVL_AF00245SB0021 [1,0,0,0,1,0|1,0,1]=4 85 B21R3.12775 CN1CC(C1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB0021 [1,0,0,0,1,0|0,1,1]=4 86 B21R3.12775 CN1CC(C1)C(=O)Nc2ncc(o2)c3ccccc3 WXVL_AF5259SB0021 [1,0,0,0,1,0|0,1,1]=4 87 B21R3.12775 CN1CC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0021 [1,0,0,0,1,0|0,0,1]=3 88 B21R3.12775 CN1CC(C1)C(=O)Nc2ncc(s2)c3ccccc3 WXVL_AF0241SB0021 [1,0,0,0,1,0|0,0,1]=3 89 B21R3.12775 CN1CC(C1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB0021 [1,0,0,0,1,0|1,0,1]=4 90 B21R3.12775 CN1CC(C1)C(=O)Nc2nnc(s2)c3ccccc3 WXVL_AF2688SB0021 [1,0,0,0,1,0|1,0,1]=4 91 B21R3.12775 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3C[C@@H](C3)O WXVL_AF0241SB3648 [1,0,0,0,1,0|2,0,0]=4 92 B21R3.12775 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3C[C@@H](C3)O WXVL_AF0241SB3648 [1,0,0,0,1,0|2,0,0]=4 93 B21R3.12775 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3C[C@H](C3)O WXVL_AF0241SB0837 [1,0,0,0,1,0|2,0,0]=4 94 B21R3.12775 O=C(Nc1ncc(s1)c2ccccc2)[C@H]3C[C@H](C3)O WXVL_AF0241SB0837 [1,0,0,0,1,0|2,0,0]=4 95 B23R3.14887 CN1CCC(C1)C(=O)Nc2cncc(n2)c3ccccc3 WXVL_AF00237SB1540 [1,0,0,0,0,1|1,0,1]=4 96 B23R3.14887 CN1CCC(C1)C(=O)Nc2cncc(n2)c3ccccc3 WXVL_AF00237SB1540 [1,0,0,0,0,1|1,0,1]=4 97 B23R3.15067 CN1CCC(C1)C(=O)Nc2ccc(cn2)c3ccccc3 WXVL_AF0217SB1540 [1,0,0,0,0,1|1,0,1]=4 98 B23R3.15067 CN1CCC(C1)C(=O)Nc2ccc(cn2)c3ccccc3 WXVL_AF0217SB1540 [1,0,0,0,0,1|1,0,1]=4 99 B23R3.15067 CN1CCC(C1)C(=O)Nc2cnc(cn2)c3ccccc3 WXVL_AF0124SB1540 [1,0,0,0,0,1|1,0,1]=4 100 B23R3.15067 CN1CCC(C1)C(=O)Nc2cnc(cn2)c3ccccc3 WXVL_AF0124SB1540 [1,0,0,0,0,1|1,0,1]=4 101 B23R3.15067 CN1CCC(C1)C(=O)Nc2ncc(cn2)c3ccccc3 WXVL_AF5644SB1540 [1,0,0,0,0,1|1,0,1]=4 102 B23R3.15067 CN1CCC(C1)C(=O)Nc2ncc(cn2)c3ccccc3 WXVL_AF5644SB1540 [1,0,0,0,0,1|1,0,1]=4