0 B13R1.90 COc1ccccc1CCC(=O)N WXVL_AK0084SB0467 [0,1,0,0,0,0|0,0,2]=3 1 B13R1.90 COc1ccccc1CCC(=O)N WXVL_AK0084SB0467 [0,1,0,0,0,0|0,0,2]=3 2 B13R1.90 COc1ccccc1CNC(=O)C WXVL_AK0039SB0150 [0,1,0,0,0,0|1,0,1]=3 3 B13R1.90 COc1ccccc1CNC(=O)C WXVL_AK0039SB0150 [0,1,0,0,0,0|1,0,1]=3 4 B13R1.90 COc1ccccc1OCC(=O)N WXVL_AK0084SB0475 [0,1,0,0,0,0|1,0,1]=3 5 B13R1.90 COc1ccccc1OCC(=O)N WXVL_AK0084SB0475 [0,1,0,0,0,0|1,0,1]=3 6 B13R1.90 COc1cccnc1CCC(=O)N WXVL_AK0084SA0108 [0,1,0,0,0,0|1,0,2]=4 7 B13R1.90 COc1cccnc1CCC(=O)N WXVL_AK0084SA0108 [0,1,0,0,0,0|1,0,2]=4 8 B13R1.90 COc1ncccc1CCC(=O)N WXVL_AK0084SA0127 [0,1,0,0,0,0|1,0,2]=4 9 B13R1.90 COc1ncccc1CCC(=O)N WXVL_AK0084SA0127 [0,1,0,0,0,0|1,0,2]=4 10 B13R1.90 COc1ncccc1CNC(=O)C WXVL_AK1337SB0150 [0,1,0,0,0,0|2,0,1]=4 11 B13R1.90 COc1ncccc1CNC(=O)C WXVL_AK1337SB0150 [0,1,0,0,0,0|2,0,1]=4 12 B13R1.91 C#CC(=O)Nc1ccccc1OC WXVL_AG00090SB0338 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.91 C#CC(=O)Nc1ccccc1OC WXVL_AG00090SB0338 [0,1,0,0,0,0|2,0,1]=4 14 B13R1.91 CCC(=O)Nc1ccccc1OC WXVL_AG00090SB0064 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.91 CCC(=O)Nc1ccccc1OC WXVL_AG00090SB0064 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.91 CNC(=O)Cc1ccccc1OC WXVL_AK00442SB0427 [0,1,0,0,0,0|2,0,1]=4 17 B13R1.91 CNC(=O)Cc1ccccc1OC WXVL_AK00442SB0427 [0,1,0,0,0,0|2,0,1]=4 18 B13R1.91 CNC(=O)Nc1ccccc1OC WXVL_AK00442YV0010 [0,1,0,0,0,0|3,0,0]=4 19 B13R1.91 CNC(=O)Nc1ccccc1OC WXVL_AK00442YV0010 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.91 COc1ccccc1NC(=O)CO WXVL_AG00090SB2706 [0,1,0,0,0,0|1,0,2]=4 21 B13R1.91 COc1ccccc1NC(=O)CO WXVL_AG00090SB2706 [0,1,0,0,0,0|1,0,2]=4 22 B13R1.464 CCNC(=O)c1ccccc1OC WXVL_AK00476SD0016 [0,1,0,0,0,0|2,0,1]=4 23 B13R1.464 CCNC(=O)c1ccccc1OC WXVL_AK00476SD0016 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [1,1,0,0,0,0|1,0,1]=4 25 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [1,1,0,0,0,0|1,0,1]=4 26 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [1,1,0,0,0,0|1,0,1]=4 27 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [1,1,0,0,0,0|1,0,1]=4 28 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [1,1,0,0,0,0|0,0,2]=4 29 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [1,1,0,0,0,0|0,0,2]=4 30 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.125 NC(=O)C=Cc1ccccc1Br WXVL_AK0084SB3065 [1,1,0,0,0,0|1,0,0]=3 33 B12R1.125 NC(=O)C=Cc1ccccc1Br WXVL_AK0084SB3065 [1,1,0,0,0,0|1,0,0]=3 34 B12R1.75 COc1ccccc1CC(=O)N WXVL_AK0084SB0427 [1,1,0,0,0,0|0,0,1]=3 35 B12R1.75 COc1ccccc1CC(=O)N WXVL_AK0084SB0427 [1,1,0,0,0,0|0,0,1]=3 36 B12R1.75 COc1ccccc1NC(=O)C WXVL_AG00090SB0150 [1,1,0,0,0,0|1,0,0]=3 37 B12R1.75 COc1ccccc1NC(=O)C WXVL_AG00090SB0150 [1,1,0,0,0,0|1,0,0]=3 38 B12R1.75 COc1cccnc1NC(=O)C WXVL_AF0674SB0150 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.75 COc1cccnc1NC(=O)C WXVL_AF0674SB0150 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.75 COc1ccncc1NC(=O)C WXVL_AF0749SB0150 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.75 COc1ccncc1NC(=O)C WXVL_AF0749SB0150 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.75 COc1ncccc1NC(=O)C WXVL_AF0081SB0150 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.75 COc1ncccc1NC(=O)C WXVL_AF0081SB0150 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.75 CSc1ccccc1NC(=O)C WXVL_AG0585SB0150 [1,1,0,0,0,0|1,1,0]=4 45 B12R1.75 CSc1ccccc1NC(=O)C WXVL_AG0585SB0150 [1,1,0,0,0,0|1,1,0]=4 46 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [1,1,0,0,0,0|1,0,1]=4 48 B14R1.1600 COc1cc(ccc1CNC(=O)C)F WXVL_AK2887SB0150 [0,2,0,0,0,0|1,0,1]=4 49 B14R1.1600 COc1cc(ccc1CNC(=O)C)F WXVL_AK2887SB0150 [0,2,0,0,0,0|1,0,1]=4 50 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,2,0,0,0,0|0,0,2]=4 51 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,2,0,0,0,0|0,0,2]=4 52 B14R1.863 C#CC(=O)NCc1ccccc1OC WXVL_AK0039SB0338 [0,2,0,0,0,0|1,0,1]=4 53 B14R1.863 C#CC(=O)NCc1ccccc1OC WXVL_AK0039SB0338 [0,2,0,0,0,0|1,0,1]=4 54 B14R1.863 CCC(=O)NCc1ccccc1OC WXVL_AK0039SB0064 [0,2,0,0,0,0|1,0,1]=4 55 B14R1.863 CCC(=O)NCc1ccccc1OC WXVL_AK0039SB0064 [0,2,0,0,0,0|1,0,1]=4 56 B14R1.863 CNC(=O)CCc1ccccc1OC WXVL_AK00442SB0467 [0,2,0,0,0,0|0,0,2]=4 57 B14R1.863 CNC(=O)CCc1ccccc1OC WXVL_AK00442SB0467 [0,2,0,0,0,0|0,0,2]=4 58 B14R1.863 CNC(=O)COc1ccccc1OC WXVL_AK00442SB0475 [0,2,0,0,0,0|1,0,1]=4 59 B14R1.863 CNC(=O)COc1ccccc1OC WXVL_AK00442SB0475 [0,2,0,0,0,0|1,0,1]=4 60 B14R1.863 COc1ccccc1CNC(=O)CO WXVL_AK0039SB2706 [0,2,0,0,0,0|1,0,1]=4 61 B14R1.863 COc1ccccc1CNC(=O)CO WXVL_AK0039SB2706 [0,2,0,0,0,0|1,0,1]=4 62 B14R1.939 C=CCNC(=O)c1ccccc1OC WXVL_AK00561SD0016 [0,2,0,0,0,0|1,0,1]=4 63 B14R1.939 C=CCNC(=O)c1ccccc1OC WXVL_AK00561SD0016 [0,2,0,0,0,0|1,0,1]=4 64 B14R1.965 C/C=C/C(=O)Nc1ccccc1OC WXVL_AG00090SB0340 [0,2,0,0,0,0|1,0,0]=3 65 B14R1.965 C/C=C/C(=O)Nc1ccccc1OC WXVL_AG00090SB0340 [0,2,0,0,0,0|1,0,0]=3 66 B14R1.965 C/C=C/C(=O)Nc1ccccc1SC WXVL_AG0585SB0340 [0,2,0,0,0,0|1,1,0]=4 67 B14R1.965 C/C=C/C(=O)Nc1ccccc1SC WXVL_AG0585SB0340 [0,2,0,0,0,0|1,1,0]=4 68 B14R1.965 C/C=C/C(=O)Nc1cccnc1OC WXVL_AF0081SB0340 [0,2,0,0,0,0|2,0,0]=4 69 B14R1.965 C/C=C/C(=O)Nc1cccnc1OC WXVL_AF0081SB0340 [0,2,0,0,0,0|2,0,0]=4 70 B14R1.965 C/C=C/C(=O)Nc1cnccc1OC WXVL_AF0749SB0340 [0,2,0,0,0,0|2,0,0]=4 71 B14R1.965 C/C=C/C(=O)Nc1cnccc1OC WXVL_AF0749SB0340 [0,2,0,0,0,0|2,0,0]=4 72 B14R1.965 C/C=C/C(=O)Nc1ncccc1OC WXVL_AF0674SB0340 [0,2,0,0,0,0|2,0,0]=4 73 B14R1.965 C/C=C/C(=O)Nc1ncccc1OC WXVL_AF0674SB0340 [0,2,0,0,0,0|2,0,0]=4 74 B14R1.965 C=CCC(=O)Nc1ccccc1OC WXVL_AG00090SB2732 [0,2,0,0,0,0|1,0,1]=4 75 B14R1.965 C=CCC(=O)Nc1ccccc1OC WXVL_AG00090SB2732 [0,2,0,0,0,0|1,0,1]=4 76 B14R1.482 CCOc1ccccc1CNC(=O)C WXVL_AK9632SB0150 [0,2,0,0,0,0|1,0,1]=4 77 B14R1.482 CCOc1ccccc1CNC(=O)C WXVL_AK9632SB0150 [0,2,0,0,0,0|1,0,1]=4 78 B14R1.840 COc1ccccc1[C@@H](C)NC(=O)C WXVL_AK3559SB0150 [0,2,0,0,0,0|1,0,1]=4 79 B14R1.840 COc1ccccc1[C@@H](C)NC(=O)C WXVL_AK3559SB0150 [0,2,0,0,0,0|1,0,1]=4 80 B14R1.1865 COc1ccc(cc1/C=C/C(=O)N)Br WXVL_AK0084SB2418 [0,2,0,0,0,0|0,0,0]=2 81 B14R1.1865 COc1ccc(cc1/C=C/C(=O)N)Br WXVL_AK0084SB2418 [0,2,0,0,0,0|0,0,0]=2 82 B14R1.1865 COc1ccc(cc1CNC(=O)C)Br WXVL_AK2768SB0150 [0,2,0,0,0,0|1,0,1]=4 83 B14R1.1865 COc1ccc(cc1CNC(=O)C)Br WXVL_AK2768SB0150 [0,2,0,0,0,0|1,0,1]=4 84 B14R1.2172 COc1cccc(c1CNC(=O)C)F WXVL_AK1464SB0150 [0,2,0,0,0,0|1,0,1]=4 85 B14R1.2172 COc1cccc(c1CNC(=O)C)F WXVL_AK1464SB0150 [0,2,0,0,0,0|1,0,1]=4 86 B14R1.3135 C=C(F)C(=O)Nc1ccccc1OC WXVL_AG00090SB1376 [0,2,0,0,0,0|2,0,0]=4 87 B14R1.3135 C=C(F)C(=O)Nc1ccccc1OC WXVL_AG00090SB1376 [0,2,0,0,0,0|2,0,0]=4 88 B14R1.3135 COc1ccccc1NC(=O)C(=O)C WXVL_AG00090SB0051 [0,2,0,0,0,0|1,0,0]=3 89 B14R1.3135 COc1ccccc1NC(=O)C(=O)C WXVL_AG00090SB0051 [0,2,0,0,0,0|1,0,0]=3 90 B14R1.3135 COc1ccccc1NC(=O)C(=O)N WXVL_AG00090SB0128 [0,2,0,0,0,0|1,0,0]=3 91 B14R1.3135 COc1ccccc1NC(=O)C(=O)N WXVL_AG00090SB0128 [0,2,0,0,0,0|1,0,0]=3 92 B14R1.3135 COc1cccnc1NC(=O)C(=O)C WXVL_AF0674SB0051 [0,2,0,0,0,0|2,0,0]=4 93 B14R1.3135 COc1cccnc1NC(=O)C(=O)C WXVL_AF0674SB0051 [0,2,0,0,0,0|2,0,0]=4 94 B14R1.3135 COc1cccnc1NC(=O)C(=O)N WXVL_AF0674SB0128 [0,2,0,0,0,0|2,0,0]=4 95 B14R1.3135 COc1cccnc1NC(=O)C(=O)N WXVL_AF0674SB0128 [0,2,0,0,0,0|2,0,0]=4 96 B14R1.3135 COc1ccncc1NC(=O)C(=O)C WXVL_AF0749SB0051 [0,2,0,0,0,0|2,0,0]=4 97 B14R1.3135 COc1ccncc1NC(=O)C(=O)C WXVL_AF0749SB0051 [0,2,0,0,0,0|2,0,0]=4 98 B14R1.3135 COc1ccncc1NC(=O)C(=O)N WXVL_AF0749SB0128 [0,2,0,0,0,0|2,0,0]=4 99 B14R1.3135 COc1ccncc1NC(=O)C(=O)N WXVL_AF0749SB0128 [0,2,0,0,0,0|2,0,0]=4 100 B14R1.3135 COc1ncccc1NC(=O)C(=O)C WXVL_AF0081SB0051 [0,2,0,0,0,0|2,0,0]=4 101 B14R1.3135 COc1ncccc1NC(=O)C(=O)C WXVL_AF0081SB0051 [0,2,0,0,0,0|2,0,0]=4 102 B14R1.3135 COc1ncccc1NC(=O)C(=O)N WXVL_AF0081SB0128 [0,2,0,0,0,0|2,0,0]=4 103 B14R1.3135 COc1ncccc1NC(=O)C(=O)N WXVL_AF0081SB0128 [0,2,0,0,0,0|2,0,0]=4 104 B14R1.3135 CSc1ccccc1NC(=O)C(=O)C WXVL_AG0585SB0051 [0,2,0,0,0,0|1,1,0]=4 105 B14R1.3135 CSc1ccccc1NC(=O)C(=O)C WXVL_AG0585SB0051 [0,2,0,0,0,0|1,1,0]=4 106 B14R1.3135 CSc1ccccc1NC(=O)C(=O)N WXVL_AG0585SB0128 [0,2,0,0,0,0|1,1,0]=4 107 B14R1.3135 CSc1ccccc1NC(=O)C(=O)N WXVL_AG0585SB0128 [0,2,0,0,0,0|1,1,0]=4 108 B14R1.4522 NC(=O)/C=C/c1ccccc1[N+](=O)[O-] WXVL_AK0084SB0510 [0,2,0,0,0,0|2,0,0]=4 109 B14R1.4522 NC(=O)/C=C/c1ccccc1[N+](=O)[O-] WXVL_AK0084SB0510 [0,2,0,0,0,0|2,0,0]=4 110 B14R2.98 CCc1ccccc1c2cccs2 WXVL_LR0498BT3340 [0,1,0,1,0,0|1,1,0]=4 111 B14R2.98 CCc1ccccc1c2ccon2 WXVL_LR0685BT3340 [0,1,0,1,0,0|1,0,1]=4 112 B14R2.98 CCc1ccccc1c2cnc[nH]2 WXVL_LR0418BT3340 [0,1,0,1,0,0|2,0,0]=4 113 B14R2.98 COc1ccccc1c2cccs2 WXVL_LR0498BT1572 [0,1,0,1,0,0|0,1,0]=3 114 B14R2.98 COc1ccccc1c2cccs2 WXVL_LR0498BT4141 [0,1,0,1,0,0|0,1,0]=3 115 B14R2.98 COc1ccccc1c2ccon2 WXVL_LR0685BT1572 [0,1,0,1,0,0|0,0,1]=3 116 B14R2.98 COc1ccccc1c2ccon2 WXVL_LR0685BT4141 [0,1,0,1,0,0|0,0,1]=3 117 B14R2.98 COc1ccccc1c2cn[nH]n2 WXVL_LR0395BT1572 [0,1,0,1,0,0|2,0,0]=4 118 B14R2.98 COc1ccccc1c2cn[nH]n2 WXVL_LR0395BT4141 [0,1,0,1,0,0|2,0,0]=4 119 B14R2.98 COc1ccccc1c2cnc[nH]2 WXVL_LR0418BT1572 [0,1,0,1,0,0|1,0,0]=3 120 B14R2.98 COc1ccccc1c2cnc[nH]2 WXVL_LR0418BT4141 [0,1,0,1,0,0|1,0,0]=3 121 B14R2.98 COc1ccccc1c2cnoc2 WXVL_LR0706BT1572 [0,1,0,1,0,0|1,0,1]=4 122 B14R2.98 COc1ccccc1c2cnoc2 WXVL_LR0706BT4141 [0,1,0,1,0,0|1,0,1]=4 123 B14R2.98 COc1ccccc1c2cnsc2 WXVL_LR0652BT1572 [0,1,0,1,0,0|1,1,0]=4 124 B14R2.98 COc1ccccc1c2cnsc2 WXVL_LR0652BT4141 [0,1,0,1,0,0|1,1,0]=4 125 B14R2.98 COc1ccccc1c2nc[nH]n2 WXVL_LR0419BT1572 [0,1,0,1,0,0|2,0,0]=4 126 B14R2.98 COc1ccccc1c2nc[nH]n2 WXVL_LR0419BT4141 [0,1,0,1,0,0|2,0,0]=4 127 B14R2.98 COc1ccccc1c2ncns2 WXVL_LR0623BT1572 [0,1,0,1,0,0|1,1,0]=4 128 B14R2.98 COc1ccccc1c2ncns2 WXVL_LR0623BT4141 [0,1,0,1,0,0|1,1,0]=4 129 B14R2.98 COc1ccncc1c2cccs2 WXVL_LR0498BT1023 [0,1,0,1,0,0|1,1,0]=4 130 B14R2.98 COc1ccncc1c2cccs2 WXVL_LR0498BT1922 [0,1,0,1,0,0|1,1,0]=4 131 B14R2.98 COc1ccncc1c2ccon2 WXVL_LR0685BT1023 [0,1,0,1,0,0|1,0,1]=4 132 B14R2.98 COc1ccncc1c2ccon2 WXVL_LR0685BT1922 [0,1,0,1,0,0|1,0,1]=4 133 B14R2.98 COc1ccncc1c2cnc[nH]2 WXVL_LR0418BT1023 [0,1,0,1,0,0|2,0,0]=4 134 B14R2.98 COc1ccncc1c2cnc[nH]2 WXVL_LR0418BT1922 [0,1,0,1,0,0|2,0,0]=4 135 B14R2.98 COc1cnccc1c2cccs2 WXVL_LR0498BT2183 [0,1,0,1,0,0|1,1,0]=4 136 B14R2.98 COc1cnccc1c2ccon2 WXVL_LR0685BT2183 [0,1,0,1,0,0|1,0,1]=4 137 B14R2.98 COc1cnccc1c2cnc[nH]2 WXVL_LR0418BT2183 [0,1,0,1,0,0|2,0,0]=4 138 B14R2.98 COc1ncccc1c2cccs2 WXVL_LR0498BT3547 [0,1,0,1,0,0|1,1,0]=4 139 B14R2.98 COc1ncccc1c2ccon2 WXVL_LR0685BT3547 [0,1,0,1,0,0|1,0,1]=4 140 B14R2.98 COc1ncccc1c2cnc[nH]2 WXVL_LR0418BT3547 [0,1,0,1,0,0|2,0,0]=4 141 B14R2.98 CSc1ccccc1c2cccs2 WXVL_LR0498BT2120 [0,1,0,1,0,0|0,2,0]=4 142 B14R2.98 CSc1ccccc1c2ccon2 WXVL_LR0685BT2120 [0,1,0,1,0,0|0,1,1]=4 143 B14R2.98 CSc1ccccc1c2cnc[nH]2 WXVL_LR0418BT2120 [0,1,0,1,0,0|1,1,0]=4 144 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,1,0,1,0,0|1,0,1]=4 145 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,1,0,1,0,0|1,0,1]=4 146 B14R2.2 NC(=O)Cc1noc2c1cccc2 WXVL_AK0084SA0004 [0,1,0,1,0,0|1,0,1]=4 147 B14R2.2 NC(=O)Cc1noc2c1cccc2 WXVL_AK0084SA0004 [0,1,0,1,0,0|1,0,1]=4 148 B14R2.450 Cc1c(oc2c1cccc2)C(=O)N WXVL_AK0084SE0058 [0,1,0,1,0,0|2,0,0]=4 149 B14R2.450 Cc1c(oc2c1cccc2)C(=O)N WXVL_AK0084SE0058 [0,1,0,1,0,0|2,0,0]=4 150 B14R2.450 Cn1c(cc2c1cccc2)C(=O)N WXVL_AK0084SE0003 [0,1,0,1,0,0|1,0,0]=3 151 B14R2.450 Cn1c(cc2c1cccc2)C(=O)N WXVL_AK0084SE0003 [0,1,0,1,0,0|1,0,0]=3 152 B14R2.781 NC(=O)C1COc2ccccc2O1 WXVL_AK0084SB1551 [0,1,0,1,0,0|1,0,1]=4 153 B14R2.781 NC(=O)C1COc2ccccc2O1 WXVL_AK0084SB1551 [0,1,0,1,0,0|1,0,1]=4 154 B14R2.781 NC(=O)c1cc2ccccc2cn1 WXVL_AK0084SE0464 [0,1,0,1,0,0|2,0,0]=4 155 B14R2.781 NC(=O)c1cc2ccccc2cn1 WXVL_AK0084SE0464 [0,1,0,1,0,0|2,0,0]=4 156 B14R2.781 NC(=O)c1ccc2ccccc2c1 WXVL_AK0084SE0013 [0,1,0,1,0,0|1,0,1]=4 157 B14R2.781 NC(=O)c1ccc2ccccc2c1 WXVL_AK0084SE0013 [0,1,0,1,0,0|1,0,1]=4 158 B14R2.781 NC(=O)c1cnc2ccccc2c1 WXVL_AK0084SE0006 [0,1,0,1,0,0|1,0,1]=4 159 B14R2.781 NC(=O)c1cnc2ccccc2c1 WXVL_AK0084SE0006 [0,1,0,1,0,0|1,0,1]=4