0 B14R1.135 CNC(=O)C(C)Cc1cccc(c1)Br WXVL_AK00442SB6322 [0,0,1,0,0,0|2,1,0]=4 1 B14R1.135 CNC(=O)C(C)Cc1cccc(c1)Br WXVL_AK00442SB6322 [0,0,1,0,0,0|2,1,0]=4 2 B14R1.243 CN(C)C(=O)[C@H](O)c1ccccc1Cl WXVL_AN0032SB3309 [0,0,1,0,0,0|3,0,0]=4 3 B14R1.243 CN(C)C(=O)[C@H](O)c1ccccc1Cl WXVL_AN0032SB3309 [0,0,1,0,0,0|3,0,0]=4 4 B13R1.15 CNC(=O)CCc1cccc(c1)Br WXVL_AK00442SB0278 [1,0,1,0,0,0|1,1,0]=4 5 B13R1.15 CNC(=O)CCc1cccc(c1)Br WXVL_AK00442SB0278 [1,0,1,0,0,0|1,1,0]=4 6 B13R1.15 CNC(=O)CCc1cccc(c1)C WXVL_AK00442SB1394 [1,0,1,0,0,0|2,0,0]=4 7 B13R1.15 CNC(=O)CCc1cccc(c1)C WXVL_AK00442SB1394 [1,0,1,0,0,0|2,0,0]=4 8 B13R1.15 CNC(=O)CCc1cccc(c1)O WXVL_AK00442SB3088 [1,0,1,0,0,0|2,0,0]=4 9 B13R1.15 CNC(=O)CCc1cccc(c1)O WXVL_AK00442SB3088 [1,0,1,0,0,0|2,0,0]=4 10 B13R1.15 CNC(=O)COc1cccc(c1)Cl WXVL_AK00442SB0493 [1,0,1,0,0,0|2,0,0]=4 11 B13R1.15 CNC(=O)COc1cccc(c1)Cl WXVL_AK00442SB0493 [1,0,1,0,0,0|2,0,0]=4 12 B13R1.15 O=C(CO)NCc1cccc(c1)Cl WXVL_AK0094SB2706 [1,0,1,0,0,0|2,0,0]=4 13 B13R1.15 O=C(CO)NCc1cccc(c1)Cl WXVL_AK0094SB2706 [1,0,1,0,0,0|2,0,0]=4 14 B13R1.135 CNC(=O)C(C)Cc1ccccc1 WXVL_AK00442SB3205 [1,0,1,0,0,0|2,0,0]=4 15 B13R1.135 CNC(=O)C(C)Cc1ccccc1 WXVL_AK00442SB3205 [1,0,1,0,0,0|2,0,0]=4 16 B13R1.148 CC(Cc1cccc(c1)Br)C(=O)N WXVL_AK0084SB6322 [1,0,1,0,0,0|1,1,0]=4 17 B13R1.148 CC(Cc1cccc(c1)Br)C(=O)N WXVL_AK0084SB6322 [1,0,1,0,0,0|1,1,0]=4 18 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0051 [1,0,1,0,0,0|1,0,1]=4 19 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0051 [1,0,1,0,0,0|1,0,1]=4 20 B13R1.202 CC(C)C(=O)Nc1ccccc1Br WXVL_AG00180SB0052 [1,0,1,0,0,0|1,1,0]=4 21 B13R1.202 CC(C)C(=O)Nc1ccccc1Br WXVL_AG00180SB0052 [1,0,1,0,0,0|1,1,0]=4 22 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0052 [1,0,1,0,0,0|1,0,0]=3 23 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0052 [1,0,1,0,0,0|1,0,0]=3 24 B13R1.202 CC(C)C(=O)Nc1ccccc1I WXVL_AG0385SB0052 [1,0,1,0,0,0|1,1,0]=4 25 B13R1.202 CC(C)C(=O)Nc1ccccc1I WXVL_AG0385SB0052 [1,0,1,0,0,0|1,1,0]=4 26 B13R1.202 CC(C)C(=O)Nc1cccnc1Cl WXVL_AF0009SB0052 [1,0,1,0,0,0|2,0,0]=4 27 B13R1.202 CC(C)C(=O)Nc1cccnc1Cl WXVL_AF0009SB0052 [1,0,1,0,0,0|2,0,0]=4 28 B13R1.202 CC(C)C(=O)Nc1ccncc1Cl WXVL_AF3285SB0052 [1,0,1,0,0,0|2,0,0]=4 29 B13R1.202 CC(C)C(=O)Nc1ccncc1Cl WXVL_AF3285SB0052 [1,0,1,0,0,0|2,0,0]=4 30 B13R1.202 CC(C)C(=O)Nc1cnccc1Cl WXVL_AF0294SB0052 [1,0,1,0,0,0|2,0,0]=4 31 B13R1.202 CC(C)C(=O)Nc1cnccc1Cl WXVL_AF0294SB0052 [1,0,1,0,0,0|2,0,0]=4 32 B13R1.202 CC(C)C(=O)Nc1ncccc1Cl WXVL_AF1147SB0052 [1,0,1,0,0,0|2,0,0]=4 33 B13R1.202 CC(C)C(=O)Nc1ncccc1Cl WXVL_AF1147SB0052 [1,0,1,0,0,0|2,0,0]=4 34 B13R1.202 CC(S)C(=O)Nc1ccccc1Br WXVL_AG00180SB2708 [1,0,1,0,0,0|1,1,0]=4 35 B13R1.202 CC(S)C(=O)Nc1ccccc1Br WXVL_AG00180SB2708 [1,0,1,0,0,0|1,1,0]=4 36 B13R1.202 CC(S)C(=O)Nc1ccccc1Cl WXVL_AG00129SB2708 [1,0,1,0,0,0|1,0,0]=3 37 B13R1.202 CC(S)C(=O)Nc1ccccc1Cl WXVL_AG00129SB2708 [1,0,1,0,0,0|1,0,0]=3 38 B13R1.202 CC(S)C(=O)Nc1ccccc1I WXVL_AG0385SB2708 [1,0,1,0,0,0|1,1,0]=4 39 B13R1.202 CC(S)C(=O)Nc1ccccc1I WXVL_AG0385SB2708 [1,0,1,0,0,0|1,1,0]=4 40 B13R1.202 CC(S)C(=O)Nc1cccnc1Cl WXVL_AF0009SB2708 [1,0,1,0,0,0|2,0,0]=4 41 B13R1.202 CC(S)C(=O)Nc1cccnc1Cl WXVL_AF0009SB2708 [1,0,1,0,0,0|2,0,0]=4 42 B13R1.202 CC(S)C(=O)Nc1ccncc1Cl WXVL_AF3285SB2708 [1,0,1,0,0,0|2,0,0]=4 43 B13R1.202 CC(S)C(=O)Nc1ccncc1Cl WXVL_AF3285SB2708 [1,0,1,0,0,0|2,0,0]=4 44 B13R1.202 CC(S)C(=O)Nc1cnccc1Cl WXVL_AF0294SB2708 [1,0,1,0,0,0|2,0,0]=4 45 B13R1.202 CC(S)C(=O)Nc1cnccc1Cl WXVL_AF0294SB2708 [1,0,1,0,0,0|2,0,0]=4 46 B13R1.202 CC(S)C(=O)Nc1ncccc1Cl WXVL_AF1147SB2708 [1,0,1,0,0,0|2,0,0]=4 47 B13R1.202 CC(S)C(=O)Nc1ncccc1Cl WXVL_AF1147SB2708 [1,0,1,0,0,0|2,0,0]=4 48 B13R1.202 CN(C)C(=O)Nc1ccccc1Cl WXVL_AN0032YV0007 [1,0,1,0,0,0|2,0,0]=4 49 B13R1.202 CN(C)C(=O)Nc1ccccc1Cl WXVL_AN0032YV0007 [1,0,1,0,0,0|2,0,0]=4 50 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Br WXVL_AG00180SB1085 [1,0,1,0,0,0|1,1,0]=4 51 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Br WXVL_AG00180SB1085 [1,0,1,0,0,0|1,1,0]=4 52 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB1085 [1,0,1,0,0,0|1,0,0]=3 53 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB1085 [1,0,1,0,0,0|1,0,0]=3 54 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1I WXVL_AG0385SB1085 [1,0,1,0,0,0|1,1,0]=4 55 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1I WXVL_AG0385SB1085 [1,0,1,0,0,0|1,1,0]=4 56 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1Cl WXVL_AF0009SB1085 [1,0,1,0,0,0|2,0,0]=4 57 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1Cl WXVL_AF0009SB1085 [1,0,1,0,0,0|2,0,0]=4 58 B13R1.202 C[C@@H](O)C(=O)Nc1ccncc1Cl WXVL_AF3285SB1085 [1,0,1,0,0,0|2,0,0]=4 59 B13R1.202 C[C@@H](O)C(=O)Nc1ccncc1Cl WXVL_AF3285SB1085 [1,0,1,0,0,0|2,0,0]=4 60 B13R1.202 C[C@@H](O)C(=O)Nc1cnccc1Cl WXVL_AF0294SB1085 [1,0,1,0,0,0|2,0,0]=4 61 B13R1.202 C[C@@H](O)C(=O)Nc1cnccc1Cl WXVL_AF0294SB1085 [1,0,1,0,0,0|2,0,0]=4 62 B13R1.202 C[C@@H](O)C(=O)Nc1ncccc1Cl WXVL_AF1147SB1085 [1,0,1,0,0,0|2,0,0]=4 63 B13R1.202 C[C@@H](O)C(=O)Nc1ncccc1Cl WXVL_AF1147SB1085 [1,0,1,0,0,0|2,0,0]=4 64 B13R1.202 Cc1ccccc1NC(=O)C(C)C WXVL_AG0027SB0052 [1,0,1,0,0,0|2,0,0]=4 65 B13R1.202 Cc1ccccc1NC(=O)C(C)C WXVL_AG0027SB0052 [1,0,1,0,0,0|2,0,0]=4 66 B13R1.202 Cc1ccccc1NC(=O)C(C)S WXVL_AG0027SB2708 [1,0,1,0,0,0|2,0,0]=4 67 B13R1.202 Cc1ccccc1NC(=O)C(C)S WXVL_AG0027SB2708 [1,0,1,0,0,0|2,0,0]=4 68 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O WXVL_AG0027SB1085 [1,0,1,0,0,0|2,0,0]=4 69 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O WXVL_AG0027SB1085 [1,0,1,0,0,0|2,0,0]=4 70 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0128 [1,0,1,0,0,0|1,0,1]=4 71 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0128 [1,0,1,0,0,0|1,0,1]=4 72 B13R1.202 O=C(Nc1ccccc1Cl)C(F)F WXVL_AG00129SB0079 [1,0,1,0,0,0|2,0,0]=4 73 B13R1.202 O=C(Nc1ccccc1Cl)C(F)F WXVL_AG00129SB0079 [1,0,1,0,0,0|2,0,0]=4 74 B13R1.696 CNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00442SB3309 [1,0,1,0,0,0|2,0,0]=4 75 B13R1.696 CNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00442SB3309 [1,0,1,0,0,0|2,0,0]=4 76 B13R1.4928 C#CC(=O)Nc1c(cccc1Cl)C WXVL_AG0023SB0338 [1,0,1,0,0,0|1,0,1]=4 77 B13R1.4928 C#CC(=O)Nc1c(cccc1Cl)C WXVL_AG0023SB0338 [1,0,1,0,0,0|1,0,1]=4 78 B13R1.4928 CCC(=O)Nc1c(cccc1Br)C WXVL_AG0460SB0064 [1,0,1,0,0,0|1,1,0]=4 79 B13R1.4928 CCC(=O)Nc1c(cccc1Br)C WXVL_AG0460SB0064 [1,0,1,0,0,0|1,1,0]=4 80 B13R1.4928 CCC(=O)Nc1c(cccc1Br)Cl WXVL_AG0448SB0064 [1,0,1,0,0,0|2,0,0]=4 81 B13R1.4928 CCC(=O)Nc1c(cccc1Br)Cl WXVL_AG0448SB0064 [1,0,1,0,0,0|2,0,0]=4 82 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)C WXVL_AG0023SB0064 [1,0,1,0,0,0|1,0,0]=3 83 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)C WXVL_AG0023SB0064 [1,0,1,0,0,0|1,0,0]=3 84 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)F WXVL_AG0513SB0064 [1,0,1,0,0,0|2,0,0]=4 85 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)F WXVL_AG0513SB0064 [1,0,1,0,0,0|2,0,0]=4 86 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)O WXVL_AG1217SB0064 [1,0,1,0,0,0|2,0,0]=4 87 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)O WXVL_AG1217SB0064 [1,0,1,0,0,0|2,0,0]=4 88 B13R1.4928 CCC(=O)Nc1c(cccc1F)C WXVL_AG0816SB0064 [1,0,1,0,0,0|1,1,0]=4 89 B13R1.4928 CCC(=O)Nc1c(cccc1F)C WXVL_AG0816SB0064 [1,0,1,0,0,0|1,1,0]=4 90 B13R1.4928 CCC(=O)Nc1c(cccc1I)Cl WXVL_AG0839SB0064 [1,0,1,0,0,0|2,0,0]=4 91 B13R1.4928 CCC(=O)Nc1c(cccc1I)Cl WXVL_AG0839SB0064 [1,0,1,0,0,0|2,0,0]=4 92 B13R1.4928 CCC(=O)Nc1c(cccc1O)C WXVL_AG1331SB0064 [1,0,1,0,0,0|2,0,0]=4 93 B13R1.4928 CCC(=O)Nc1c(cccc1O)C WXVL_AG1331SB0064 [1,0,1,0,0,0|2,0,0]=4 94 B13R1.4928 CCC(=O)Nc1c(ccnc1Cl)C WXVL_AF0425SB0064 [1,0,1,0,0,0|2,0,0]=4 95 B13R1.4928 CCC(=O)Nc1c(ccnc1Cl)C WXVL_AF0425SB0064 [1,0,1,0,0,0|2,0,0]=4 96 B13R1.4928 Cc1cccc(c1NC(=O)CO)Br WXVL_AG0460SB2706 [1,0,1,0,0,0|1,1,0]=4 97 B13R1.4928 Cc1cccc(c1NC(=O)CO)Br WXVL_AG0460SB2706 [1,0,1,0,0,0|1,1,0]=4 98 B13R1.4928 Cc1cccc(c1NC(=O)CO)Cl WXVL_AG0023SB2706 [1,0,1,0,0,0|1,0,0]=3 99 B13R1.4928 Cc1cccc(c1NC(=O)CO)Cl WXVL_AG0023SB2706 [1,0,1,0,0,0|1,0,0]=3 100 B13R1.4928 Cc1cccc(c1NC(=O)CO)F WXVL_AG0816SB2706 [1,0,1,0,0,0|1,1,0]=4 101 B13R1.4928 Cc1cccc(c1NC(=O)CO)F WXVL_AG0816SB2706 [1,0,1,0,0,0|1,1,0]=4 102 B13R1.4928 Cc1cccc(c1NC(=O)CO)O WXVL_AG1331SB2706 [1,0,1,0,0,0|2,0,0]=4 103 B13R1.4928 Cc1cccc(c1NC(=O)CO)O WXVL_AG1331SB2706 [1,0,1,0,0,0|2,0,0]=4 104 B13R1.4928 Cc1ccnc(c1NC(=O)CO)Cl WXVL_AF0425SB2706 [1,0,1,0,0,0|2,0,0]=4 105 B13R1.4928 Cc1ccnc(c1NC(=O)CO)Cl WXVL_AF0425SB2706 [1,0,1,0,0,0|2,0,0]=4 106 B13R1.4928 O=C(CO)Nc1c(cccc1Br)Cl WXVL_AG0448SB2706 [1,0,1,0,0,0|2,0,0]=4 107 B13R1.4928 O=C(CO)Nc1c(cccc1Br)Cl WXVL_AG0448SB2706 [1,0,1,0,0,0|2,0,0]=4 108 B13R1.4928 O=C(CO)Nc1c(cccc1Cl)F WXVL_AG0513SB2706 [1,0,1,0,0,0|2,0,0]=4 109 B13R1.4928 O=C(CO)Nc1c(cccc1Cl)F WXVL_AG0513SB2706 [1,0,1,0,0,0|2,0,0]=4 110 B13R1.4928 O=C(CO)Nc1c(cccc1Cl)O WXVL_AG1217SB2706 [1,0,1,0,0,0|2,0,0]=4 111 B13R1.4928 O=C(CO)Nc1c(cccc1Cl)O WXVL_AG1217SB2706 [1,0,1,0,0,0|2,0,0]=4 112 B13R1.4928 O=C(CO)Nc1c(cccc1I)Cl WXVL_AG0839SB2706 [1,0,1,0,0,0|2,0,0]=4 113 B13R1.4928 O=C(CO)Nc1c(cccc1I)Cl WXVL_AG0839SB2706 [1,0,1,0,0,0|2,0,0]=4 114 B15R1.363 CC(C)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB0052 [0,0,1,0,0,1|2,0,0]=4 115 B15R1.363 CC(C)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB0052 [0,0,1,0,0,1|2,0,0]=4 116 B15R1.363 CC(S)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB2708 [0,0,1,0,0,1|2,0,0]=4 117 B15R1.363 CC(S)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB2708 [0,0,1,0,0,1|2,0,0]=4 118 B15R1.363 C[C@@H](O)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB1085 [0,0,1,0,0,1|2,0,0]=4 119 B15R1.363 C[C@@H](O)C(=O)N(C)Cc1ccccc1Cl WXVL_AN2206SB1085 [0,0,1,0,0,1|2,0,0]=4 120 B15R1.5792 CC(C)NC(=O)[C@H](O)c1ccccc1Cl WXVL_AK0030SB3309 [0,0,1,0,0,1|2,0,0]=4 121 B15R1.5792 CC(C)NC(=O)[C@H](O)c1ccccc1Cl WXVL_AK0030SB3309 [0,0,1,0,0,1|2,0,0]=4