0 B12R2.252 NC(=O)c1cc2ccoc2s1 WXVL_AK0084SC00089 [0,0,0,0,0,0|4,0,0]=4 1 B12R2.252 NC(=O)c1cc2ccoc2s1 WXVL_AK0084SC00089 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.252 NC(=O)c1cc2ncsc2[nH]1 WXVL_AK0084SC00092 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.252 NC(=O)c1cc2ncsc2[nH]1 WXVL_AK0084SC00092 [0,0,0,0,0,0|3,0,0]=3 4 B12R2.252 NC(=O)c1cc2sccc2[nH]1 WXVL_AK0084SE0543 [0,0,0,0,0,0|2,0,0]=2 5 B12R2.252 NC(=O)c1cc2sccc2[nH]1 WXVL_AK0084SE0543 [0,0,0,0,0,0|2,0,0]=2 6 B12R2.252 NC(=O)c1cc2sccc2s1 WXVL_AK0084SE0308 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.252 NC(=O)c1cc2sccc2s1 WXVL_AK0084SE0308 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.252 NC(=O)c1cc2sccn2c1 WXVL_AK0084SC00088 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.252 NC(=O)c1cc2sccn2c1 WXVL_AK0084SC00088 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.400 Cc1cc2[nH]c(cc2s1)C(=O)N WXVL_AK0084SE0793 [0,1,0,0,0,0|2,0,0]=3 11 B13R2.400 Cc1cc2[nH]c(cc2s1)C(=O)N WXVL_AK0084SE0793 [0,1,0,0,0,0|2,0,0]=3 12 B13R2.531 CNC(=O)c1cc2ncsc2[nH]1 WXVL_AK00442SC00092 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.531 CNC(=O)c1cc2ncsc2[nH]1 WXVL_AK00442SC00092 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.531 CNC(=O)c1cc2sccc2[nH]1 WXVL_AK00442SE0543 [0,1,0,0,0,0|2,0,0]=3 15 B13R2.531 CNC(=O)c1cc2sccc2[nH]1 WXVL_AK00442SE0543 [0,1,0,0,0,0|2,0,0]=3 16 B13R2.531 CNC(=O)c1cc2sccc2s1 WXVL_AK00442SE0308 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.531 CNC(=O)c1cc2sccc2s1 WXVL_AK00442SE0308 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.35 C=C(F)C(=O)Nc1cscn1 WXVL_AF00216SB1376 [0,0,1,0,0,0|3,0,0]=4 19 B11R1.35 C=C(F)C(=O)Nc1cscn1 WXVL_AF00216SB1376 [0,0,1,0,0,0|3,0,0]=4 20 B11R1.35 CC(=O)C(=O)Nc1ccsc1 WXVL_AF00105SB0051 [0,0,1,0,0,0|3,0,0]=4 21 B11R1.35 CC(=O)C(=O)Nc1ccsc1 WXVL_AF00105SB0051 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.35 CC(=O)C(=O)Nc1cncs1 WXVL_AF0724SB0051 [0,0,1,0,0,0|3,0,0]=4 23 B11R1.35 CC(=O)C(=O)Nc1cncs1 WXVL_AF0724SB0051 [0,0,1,0,0,0|3,0,0]=4 24 B11R1.35 CC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0051 [0,0,1,0,0,0|2,0,0]=3 25 B11R1.35 CC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0051 [0,0,1,0,0,0|2,0,0]=3 26 B11R1.35 C[C@@H](O)C(=O)Nc1cscn1 WXVL_AF00216SB1085 [0,0,1,0,0,0|2,0,1]=4 27 B11R1.35 C[C@@H](O)C(=O)Nc1cscn1 WXVL_AF00216SB1085 [0,0,1,0,0,0|2,0,1]=4 28 B11R1.35 NC(=O)C(=O)Nc1ccsc1 WXVL_AF00105SB0128 [0,0,1,0,0,0|3,0,0]=4 29 B11R1.35 NC(=O)C(=O)Nc1ccsc1 WXVL_AF00105SB0128 [0,0,1,0,0,0|3,0,0]=4 30 B11R1.35 NC(=O)C(=O)Nc1cncs1 WXVL_AF0724SB0128 [0,0,1,0,0,0|3,0,0]=4 31 B11R1.35 NC(=O)C(=O)Nc1cncs1 WXVL_AF0724SB0128 [0,0,1,0,0,0|3,0,0]=4 32 B11R1.35 NC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0128 [0,0,1,0,0,0|2,0,0]=3 33 B11R1.35 NC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0128 [0,0,1,0,0,0|2,0,0]=3 34 B13R2.430 NC(=O)c1ccc2nc[nH]c2c1 WXVL_AK0084SE0374 [0,0,0,0,0,1|3,0,0]=4 35 B13R2.430 NC(=O)c1ccc2nc[nH]c2c1 WXVL_AK0084SE0374 [0,0,0,0,0,1|3,0,0]=4 36 B13R2.430 NC(=O)c1ccc2ncoc2c1 WXVL_AK0084SE0161 [0,0,0,0,0,1|2,1,0]=4 37 B13R2.430 NC(=O)c1ccc2ncoc2c1 WXVL_AK0084SE0161 [0,0,0,0,0,1|2,1,0]=4 38 B13R2.430 NC(=O)c1ccc2ncsc2c1 WXVL_AK0084SE0431 [0,0,0,0,0,1|2,0,0]=3 39 B13R2.430 NC(=O)c1ccc2ncsc2c1 WXVL_AK0084SE0431 [0,0,0,0,0,1|2,0,0]=3 40 B13R2.430 NC(=O)c1ccc2ocnc2c1 WXVL_AK0084SE0049 [0,0,0,0,0,1|2,1,0]=4 41 B13R2.430 NC(=O)c1ccc2ocnc2c1 WXVL_AK0084SE0049 [0,0,0,0,0,1|2,1,0]=4 42 B13R2.430 NC(=O)c1ccc2sccc2c1 WXVL_AK0084SE1663 [0,0,0,0,0,1|3,0,0]=4 43 B13R2.430 NC(=O)c1ccc2sccc2c1 WXVL_AK0084SE1663 [0,0,0,0,0,1|3,0,0]=4 44 B13R2.430 NC(=O)c1ccc2scnc2c1 WXVL_AK0084SE0486 [0,0,0,0,0,1|2,0,0]=3 45 B13R2.430 NC(=O)c1ccc2scnc2c1 WXVL_AK0084SE0486 [0,0,0,0,0,1|2,0,0]=3 46 B13R2.430 NC(=O)c1cnc2snnc2c1 WXVL_AK0084SC00123 [0,0,0,0,0,1|3,0,0]=4 47 B13R2.430 NC(=O)c1cnc2snnc2c1 WXVL_AK0084SC00123 [0,0,0,0,0,1|3,0,0]=4 48 B13R2.435 NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0084SE0001 [0,0,0,0,0,1|3,0,0]=4 49 B13R2.435 NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0084SE0001 [0,0,0,0,0,1|3,0,0]=4 50 B13R2.435 NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0084SE0450 [0,0,0,0,0,1|2,0,0]=3 51 B13R2.435 NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0084SE0450 [0,0,0,0,0,1|2,0,0]=3 52 B13R2.435 NC(=O)c1cc2cccnc2s1 WXVL_AK0084SE0061 [0,0,0,0,0,1|3,0,0]=4 53 B13R2.435 NC(=O)c1cc2cccnc2s1 WXVL_AK0084SE0061 [0,0,0,0,0,1|3,0,0]=4 54 B13R2.435 NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0084SE0511 [0,0,0,0,0,1|3,0,0]=4 55 B13R2.435 NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0084SE0511 [0,0,0,0,0,1|3,0,0]=4 56 B13R2.435 NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0084SE0680 [0,0,0,0,0,1|3,0,0]=4 57 B13R2.435 NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0084SE0680 [0,0,0,0,0,1|3,0,0]=4 58 B10R1.27 O=C(CO)Nc1cscn1 WXVL_AF00216SB2706 [1,0,1,0,0,0|1,0,1]=4 59 B10R1.27 O=C(CO)Nc1cscn1 WXVL_AF00216SB2706 [1,0,1,0,0,0|1,0,1]=4 60 B10R1.66 NC(=O)/C=C/c1cccs1 WXVL_AK0084SA0001 [1,0,1,0,0,0|2,0,0]=4 61 B10R1.66 NC(=O)/C=C/c1cccs1 WXVL_AK0084SA0001 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.104 CC(=O)C(=O)Nc1csc(n1)C WXVL_AF00271SB0051 [0,1,1,0,0,0|2,0,0]=4 63 B12R1.104 CC(=O)C(=O)Nc1csc(n1)C WXVL_AF00271SB0051 [0,1,1,0,0,0|2,0,0]=4 64 B12R1.104 Cc1nc(cs1)NC(=O)C(=O)N WXVL_AF00271SB0128 [0,1,1,0,0,0|2,0,0]=4 65 B12R1.104 Cc1nc(cs1)NC(=O)C(=O)N WXVL_AF00271SB0128 [0,1,1,0,0,0|2,0,0]=4 66 B12R1.108 CCC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0344 [0,1,1,0,0,0|2,0,0]=4 67 B12R1.108 CCC(=O)C(=O)Nc1cscn1 WXVL_AF00216SB0344 [0,1,1,0,0,0|2,0,0]=4 68 B14R2.601 Cc1nc2cc(ccc2s1)C(=O)N WXVL_AK0084SE0142 [0,1,0,0,0,1|2,0,0]=4 69 B14R2.601 Cc1nc2cc(ccc2s1)C(=O)N WXVL_AK0084SE0142 [0,1,0,0,0,1|2,0,0]=4 70 B14R2.601 NC(=O)c1ccc2nc(sc2c1)Br WXVL_AK0084SE0492 [0,1,0,0,0,1|2,0,0]=4 71 B14R2.601 NC(=O)c1ccc2nc(sc2c1)Br WXVL_AK0084SE0492 [0,1,0,0,0,1|2,0,0]=4 72 B14R2.601 NC(=O)c1ccc2nc(sc2c1)Cl WXVL_AK0084SE0386 [0,1,0,0,0,1|2,0,0]=4 73 B14R2.601 NC(=O)c1ccc2nc(sc2c1)Cl WXVL_AK0084SE0386 [0,1,0,0,0,1|2,0,0]=4 74 B14R2.966 CNC(=O)c1ccc2ncsc2c1 WXVL_AK00442SE0431 [0,1,0,0,0,1|2,0,0]=4 75 B14R2.966 CNC(=O)c1ccc2ncsc2c1 WXVL_AK00442SE0431 [0,1,0,0,0,1|2,0,0]=4 76 B14R2.966 CNC(=O)c1ccc2scnc2c1 WXVL_AK00442SE0486 [0,1,0,0,0,1|2,0,0]=4 77 B14R2.966 CNC(=O)c1ccc2scnc2c1 WXVL_AK00442SE0486 [0,1,0,0,0,1|2,0,0]=4 78 B14R2.972 CNC(=O)c1cc2cccnc2[nH]1 WXVL_AK00442SE0450 [0,1,0,0,0,1|2,0,0]=4 79 B14R2.972 CNC(=O)c1cc2cccnc2[nH]1 WXVL_AK00442SE0450 [0,1,0,0,0,1|2,0,0]=4 80 B14R2.4529 NC(=O)c1cc2ccc(nc2[nH]1)Cl WXVL_AK0084SE0468 [0,1,0,0,0,1|2,0,0]=4 81 B14R2.4529 NC(=O)c1cc2ccc(nc2[nH]1)Cl WXVL_AK0084SE0468 [0,1,0,0,0,1|2,0,0]=4 82 B14R2.10815 CNC(=O)c1cc2sc(cc2[nH]1)C WXVL_AK00442SE0793 [0,2,0,0,0,0|2,0,0]=4 83 B14R2.10815 CNC(=O)c1cc2sc(cc2[nH]1)C WXVL_AK00442SE0793 [0,2,0,0,0,0|2,0,0]=4 84 B14R2.839 CCNC(=O)c1cc2sccc2[nH]1 WXVL_AK00476SE0543 [0,2,0,0,0,0|2,0,0]=4 85 B14R2.839 CCNC(=O)c1cc2sccc2[nH]1 WXVL_AK00476SE0543 [0,2,0,0,0,0|2,0,0]=4 86 B12R1.264 CC(=O)C(=O)NCc1cscn1 WXVL_AK0325SB0051 [0,0,1,0,0,1|2,0,0]=4 87 B12R1.264 CC(=O)C(=O)NCc1cscn1 WXVL_AK0325SB0051 [0,0,1,0,0,1|2,0,0]=4 88 B12R1.264 NC(=O)C(=O)NCc1cscn1 WXVL_AK0325SB0128 [0,0,1,0,0,1|2,0,0]=4 89 B12R1.264 NC(=O)C(=O)NCc1cscn1 WXVL_AK0325SB0128 [0,0,1,0,0,1|2,0,0]=4 90 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 WXVL_AG0083SB0150 [0,0,0,0,0,2|2,0,0]=4 91 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 WXVL_AG0083SB0150 [0,0,0,0,0,2|2,0,0]=4 92 B14R2.1008 CC(=O)Nc1ccc2scnc2c1 WXVL_AG0918SB0150 [0,0,0,0,0,2|2,0,0]=4 93 B14R2.1008 CC(=O)Nc1ccc2scnc2c1 WXVL_AG0918SB0150 [0,0,0,0,0,2|2,0,0]=4