0 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.91 NC(=O)/C=C/c1cccnc1 WXVL_AK0084SA0193 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.91 NC(=O)/C=C/c1cccnc1 WXVL_AK0084SA0193 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.91 NC(=O)/C=C/c1cnccn1 WXVL_AK0084SA2885 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.91 NC(=O)/C=C/c1cnccn1 WXVL_AK0084SA2885 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [0,0,0,0,0,0|1,0,2]=3 15 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [0,0,0,0,0,0|1,0,2]=3 16 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [0,0,0,0,0,0|1,0,2]=3 17 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [0,0,0,0,0,0|1,0,2]=3 18 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [0,0,0,0,0,0|2,0,1]=3 24 B11R1.91 NC(=O)COc1cccnc1 WXVL_AK0084SA0051 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.91 NC(=O)COc1cccnc1 WXVL_AK0084SA0051 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [0,0,0,0,0,0|2,0,1]=3 27 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.91 NC(=O)CSc1ccncc1 WXVL_AK0084SA0055 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.91 NC(=O)CSc1ccncc1 WXVL_AK0084SA0055 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [0,1,0,0,0,0|2,0,1]=4 35 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [0,1,0,0,0,0|2,0,1]=4 37 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [0,1,0,0,0,0|2,0,1]=4 38 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [0,1,0,0,0,0|2,0,1]=4 39 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [0,1,0,0,0,0|2,0,1]=4 41 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.21 Cc1ccc(cc1)C=CC(=O)N WXVL_AK0084SB0060 [0,1,0,0,0,0|1,0,0]=2 43 B12R1.21 Cc1ccc(cc1)C=CC(=O)N WXVL_AK0084SB0060 [0,1,0,0,0,0|1,0,0]=2 44 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [0,1,0,0,0,0|1,0,2]=4 45 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [0,1,0,0,0,0|1,0,2]=4 46 B12R1.21 Cc1ccc(cc1)OCC(=O)N WXVL_AK0084SB0138 [0,1,0,0,0,0|2,0,1]=4 47 B12R1.21 Cc1ccc(cc1)OCC(=O)N WXVL_AK0084SB0138 [0,1,0,0,0,0|2,0,1]=4 48 B12R1.21 Cc1ccc(cc1)SCC(=O)N WXVL_AK0084SB0830 [0,1,0,0,0,0|2,0,1]=4 49 B12R1.21 Cc1ccc(cc1)SCC(=O)N WXVL_AK0084SB0830 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.21 NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0084SB0418 [0,1,0,0,0,0|1,0,0]=2 51 B12R1.21 NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0084SB0418 [0,1,0,0,0,0|1,0,0]=2 52 B12R1.21 NC(=O)C#Cc1ccc(cc1)Cl WXVL_AK0084SB3517 [0,1,0,0,0,0|1,0,2]=4 53 B12R1.21 NC(=O)C#Cc1ccc(cc1)Cl WXVL_AK0084SB3517 [0,1,0,0,0,0|1,0,2]=4 54 B12R1.21 NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0084SB1122 [0,1,0,0,0,0|1,0,0]=2 55 B12R1.21 NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0084SB1122 [0,1,0,0,0,0|1,0,0]=2 56 B12R1.21 NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0084SB0119 [0,1,0,0,0,0|1,0,0]=2 57 B12R1.21 NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0084SB0119 [0,1,0,0,0,0|1,0,0]=2 58 B12R1.21 NC(=O)C=Cc1ccc(cc1)F WXVL_AK0084SB1186 [0,1,0,0,0,0|1,0,0]=2 59 B12R1.21 NC(=O)C=Cc1ccc(cc1)F WXVL_AK0084SB1186 [0,1,0,0,0,0|1,0,0]=2 60 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [0,1,0,0,0,0|1,0,2]=4 61 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [0,1,0,0,0,0|1,0,2]=4 62 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [0,1,0,0,0,0|1,0,2]=4 63 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [0,1,0,0,0,0|1,0,2]=4 64 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [0,1,0,0,0,0|1,0,2]=4 65 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [0,1,0,0,0,0|1,0,2]=4 66 B12R1.21 NC(=O)COc1ccc(cc1)F WXVL_AK0084SB0088 [0,1,0,0,0,0|2,0,1]=4 67 B12R1.21 NC(=O)COc1ccc(cc1)F WXVL_AK0084SB0088 [0,1,0,0,0,0|2,0,1]=4 68 B12R1.21 NC(=O)COc1ccc(cc1)O WXVL_AK0084SB3388 [0,1,0,0,0,0|2,0,1]=4 69 B12R1.21 NC(=O)COc1ccc(cc1)O WXVL_AK0084SB3388 [0,1,0,0,0,0|2,0,1]=4 70 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [0,1,0,0,0,0|2,0,1]=4 71 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [0,1,0,0,0,0|2,0,1]=4 72 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,1,0,0,0,0|2,0,1]=4 73 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,1,0,0,0,0|2,0,1]=4 74 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,1,0,0,0,0|1,0,0]=2 75 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,1,0,0,0,0|1,0,0]=2 76 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,1,0,0,0,0|2,0,0]=3 77 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,1,0,0,0,0|2,0,0]=3 78 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,1,0,0,0,0|3,0,0]=4 80 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,1,0,0,0,0|1,0,2]=4 81 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,1,0,0,0,0|1,0,2]=4 82 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,1,0,0,0,0|1,0,2]=4 83 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,1,0,0,0,0|1,0,2]=4 84 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,1,0,0,0,0|2,0,1]=4 85 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [0,1,0,0,0,0|1,0,1]=3 89 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [0,1,0,0,0,0|1,0,1]=3 90 B12R1.27 O=C(CO)NCc1ccccn1 WXVL_AK0018SB2706 [0,1,0,0,0,0|2,0,1]=4 91 B12R1.27 O=C(CO)NCc1ccccn1 WXVL_AK0018SB2706 [0,1,0,0,0,0|2,0,1]=4 92 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [0,1,0,0,0,0|2,0,1]=4 93 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [0,1,0,0,0,0|2,0,1]=4 94 B12R1.27 O=C(CO)NCc1ccncc1 WXVL_AK0021SB2706 [0,1,0,0,0,0|2,0,1]=4 95 B12R1.27 O=C(CO)NCc1ccncc1 WXVL_AK0021SB2706 [0,1,0,0,0,0|2,0,1]=4 96 B12R1.43 C/C(=C\c1cccnc1)/C(=O)N WXVL_AK0084SA1933 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.43 C/C(=C\c1cccnc1)/C(=O)N WXVL_AK0084SA1933 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [0,1,0,0,0,0|1,0,1]=3 99 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [0,1,0,0,0,0|1,0,1]=3 100 B12R1.43 C=C(F)C(=O)Nc1ccccc1 WXVL_AG00183SB1376 [0,1,0,0,0,0|3,0,0]=4 101 B12R1.43 C=C(F)C(=O)Nc1ccccc1 WXVL_AG00183SB1376 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,0|2,0,0]=3 103 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,0|2,0,0]=3 104 B12R1.43 CC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0051 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.43 CC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0051 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [0,1,0,0,0,0|1,0,2]=4 109 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [0,1,0,0,0,0|1,0,2]=4 110 B12R1.43 CC(Oc1ccccc1)C(=O)N WXVL_AK0084SB0426 [0,1,0,0,0,0|2,0,1]=4 111 B12R1.43 CC(Oc1ccccc1)C(=O)N WXVL_AK0084SB0426 [0,1,0,0,0,0|2,0,1]=4 112 B12R1.43 CC(Sc1ccccc1)C(=O)N WXVL_AK0084SB9992 [0,1,0,0,0,0|2,0,1]=4 113 B12R1.43 CC(Sc1ccccc1)C(=O)N WXVL_AK0084SB9992 [0,1,0,0,0,0|2,0,1]=4 114 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,0|2,0,1]=4 115 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,0|2,0,1]=4 116 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)N WXVL_AK0084SB5803 [0,1,0,0,0,0|2,0,1]=4 117 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)N WXVL_AK0084SB5803 [0,1,0,0,0,0|2,0,1]=4 118 B12R1.43 NC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0128 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.43 NC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0128 [0,1,0,0,0,0|2,0,0]=3 120 B12R1.43 NC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0128 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.43 NC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0128 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,1,0,0,0,0|1,0,2]=4 123 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,1,0,0,0,0|1,0,2]=4 124 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,1,0,0,0,0|1,0,2]=4 125 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,1,0,0,0,0|1,0,2]=4 126 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [0,1,0,0,0,0|2,0,1]=4 127 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [0,1,0,0,0,0|2,0,1]=4 129 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [0,1,0,0,0,0|2,0,1]=4 130 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [0,1,0,0,0,0|2,0,1]=4 131 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [0,1,0,0,0,0|2,0,1]=4 133 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [0,1,0,0,0,0|2,0,1]=4 134 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [0,1,0,0,0,0|2,0,1]=4 135 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [0,1,0,0,0,0|2,0,1]=4 138 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [0,1,0,0,0,0|1,0,2]=4 139 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [0,1,0,0,0,0|1,0,2]=4 140 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.125 NC(=O)C=Cc1ccccc1Br WXVL_AK0084SB3065 [0,1,0,0,0,0|1,0,0]=2 143 B12R1.125 NC(=O)C=Cc1ccccc1Br WXVL_AK0084SB3065 [0,1,0,0,0,0|1,0,0]=2 144 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [0,1,0,0,0,0|1,0,2]=4 145 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [0,1,0,0,0,0|1,0,2]=4 146 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [0,1,0,0,0,0|1,0,2]=4 147 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [0,1,0,0,0,0|1,0,2]=4 148 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [0,1,0,0,0,0|1,0,2]=4 149 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [0,1,0,0,0,0|1,0,2]=4 150 B12R1.125 NC(=O)COc1ccccc1F WXVL_AK0084SB0441 [0,1,0,0,0,0|2,0,1]=4 151 B12R1.125 NC(=O)COc1ccccc1F WXVL_AK0084SB0441 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [0,1,0,0,0,0|2,0,1]=4 154 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [0,1,0,0,0,0|2,0,1]=4 156 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [0,1,0,0,0,0|2,0,1]=4 157 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [0,1,0,0,0,0|2,0,1]=4 158 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [0,1,0,0,0,0|2,0,1]=4 159 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [0,1,0,0,0,0|2,0,1]=4 160 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [0,1,0,0,0,0|2,0,1]=4 161 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [0,1,0,0,0,0|2,0,1]=4 162 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [0,1,0,0,0,0|1,0,2]=4 165 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [0,1,0,0,0,0|1,0,2]=4 166 B12R1.226 NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0084SB1601 [0,1,0,0,0,0|1,0,0]=2 167 B12R1.226 NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0084SB1601 [0,1,0,0,0,0|1,0,0]=2 168 B12R1.226 NC(=O)C=Cc1cccc(c1)O WXVL_AK0084SB0417 [0,1,0,0,0,0|1,0,0]=2 169 B12R1.226 NC(=O)C=Cc1cccc(c1)O WXVL_AK0084SB0417 [0,1,0,0,0,0|1,0,0]=2 170 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [0,1,0,0,0,0|1,0,2]=4 171 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [0,1,0,0,0,0|1,0,2]=4 172 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [0,1,0,0,0,0|1,0,2]=4 173 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [0,1,0,0,0,0|1,0,2]=4 174 B12R1.226 NC(=O)COc1cccc(c1)Cl WXVL_AK0084SB0493 [0,1,0,0,0,0|2,0,1]=4 175 B12R1.226 NC(=O)COc1cccc(c1)Cl WXVL_AK0084SB0493 [0,1,0,0,0,0|2,0,1]=4 176 B12R1.891 NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0084HU0026 [0,1,0,0,0,0|1,0,1]=3 177 B12R1.891 NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0084HU0026 [0,1,0,0,0,0|1,0,1]=3 178 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,1,0|2,0,0]=3 179 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,1,0|2,0,0]=3 180 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,1,0|3,0,0]=4 181 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,1,0|3,0,0]=4 182 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,1,0|1,0,1]=3 183 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,1,0|1,0,1]=3 184 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [0,0,0,0,1,0|2,0,1]=4 185 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [0,0,0,0,1,0|2,0,1]=4 186 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [0,0,0,0,1,0|2,0,1]=4 187 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [0,0,0,0,1,0|2,0,1]=4 188 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [0,0,0,0,1,0|2,0,1]=4 189 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [0,0,0,0,1,0|2,0,1]=4 190 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [0,0,0,0,1,0|2,0,1]=4 191 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [0,0,0,0,1,0|2,0,1]=4 192 B10R1.66 NC(=O)/C=C/c1c[nH]cn1 WXVL_AK0084SA0730 [0,0,0,0,1,0|3,0,0]=4 193 B10R1.66 NC(=O)/C=C/c1c[nH]cn1 WXVL_AK0084SA0730 [0,0,0,0,1,0|3,0,0]=4 194 B10R1.66 NC(=O)/C=C/c1ccco1 WXVL_AK0084SA0180 [0,0,0,0,1,0|2,0,0]=3 195 B10R1.66 NC(=O)/C=C/c1ccco1 WXVL_AK0084SA0180 [0,0,0,0,1,0|2,0,0]=3 196 B10R1.66 NC(=O)/C=C/c1cccs1 WXVL_AK0084SA0001 [0,0,0,0,1,0|2,0,0]=3 197 B10R1.66 NC(=O)/C=C/c1cccs1 WXVL_AK0084SA0001 [0,0,0,0,1,0|2,0,0]=3 198 B10R1.66 NC(=O)/C=C/c1ccoc1 WXVL_AK0084SA0047 [0,0,0,0,1,0|2,0,0]=3 199 B10R1.66 NC(=O)/C=C/c1ccoc1 WXVL_AK0084SA0047 [0,0,0,0,1,0|2,0,0]=3 200 B10R1.66 NC(=O)/C=C/c1ccsc1 WXVL_AK0084SA0251 [0,0,0,0,1,0|2,0,0]=3 201 B10R1.66 NC(=O)/C=C/c1ccsc1 WXVL_AK0084SA0251 [0,0,0,0,1,0|2,0,0]=3 202 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [0,0,0,0,0,1|1,0,2]=4 203 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [0,0,0,0,0,1|1,0,2]=4 204 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [0,0,0,0,0,1|1,0,2]=4 205 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [0,0,0,0,0,1|1,0,2]=4 206 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [0,0,0,0,0,1|1,0,2]=4 207 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [0,0,0,0,0,1|1,0,2]=4 208 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [0,0,0,0,0,1|1,0,2]=4 209 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [0,0,0,0,0,1|1,0,2]=4 210 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [1,1,0,0,0,0|1,0,1]=4 211 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [1,1,0,0,0,0|1,0,1]=4 212 B11R1.20 CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0150 [0,1,0,0,1,0|2,0,0]=4 213 B11R1.20 CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0150 [0,1,0,0,1,0|2,0,0]=4 214 B11R1.20 CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0150 [0,1,0,0,1,0|2,0,0]=4 215 B11R1.20 CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0150 [0,1,0,0,1,0|2,0,0]=4 216 B11R1.20 Cc1ccc(cc1)CC(=O)N WXVL_AK0084SB0112 [0,1,0,0,1,0|1,0,1]=4 217 B11R1.20 Cc1ccc(cc1)CC(=O)N WXVL_AK0084SB0112 [0,1,0,0,1,0|1,0,1]=4 218 B11R1.20 NC(=O)Cc1ccc(cc1)Br WXVL_AK0084SB0926 [0,1,0,0,1,0|1,0,1]=4 219 B11R1.20 NC(=O)Cc1ccc(cc1)Br WXVL_AK0084SB0926 [0,1,0,0,1,0|1,0,1]=4 220 B11R1.20 NC(=O)Cc1ccc(cc1)Cl WXVL_AK0084SB0107 [0,1,0,0,1,0|1,0,1]=4 221 B11R1.20 NC(=O)Cc1ccc(cc1)Cl WXVL_AK0084SB0107 [0,1,0,0,1,0|1,0,1]=4 222 B11R1.20 NC(=O)Cc1ccc(cc1)F WXVL_AK0084SB0106 [0,1,0,0,1,0|1,0,1]=4 223 B11R1.20 NC(=O)Cc1ccc(cc1)F WXVL_AK0084SB0106 [0,1,0,0,1,0|1,0,1]=4 224 B11R1.20 NC(=O)Cc1ccc(cc1)O WXVL_AK0084SB0110 [0,1,0,0,1,0|1,0,1]=4 225 B11R1.20 NC(=O)Cc1ccc(cc1)O WXVL_AK0084SB0110 [0,1,0,0,1,0|1,0,1]=4 226 B11R1.36 CC(C(=O)N)c1ccccc1 WXVL_AK0084SB2326 [0,1,0,0,1,0|1,0,1]=4 227 B11R1.36 CC(C(=O)N)c1ccccc1 WXVL_AK0084SB2326 [0,1,0,0,1,0|1,0,1]=4 228 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,1,0|1,0,0]=3 229 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,1,0|1,0,0]=3 230 B11R1.36 NC(=O)C(O)c1ccccc1 WXVL_AK0084SB0168 [0,1,0,0,1,0|1,0,1]=4 231 B11R1.36 NC(=O)C(O)c1ccccc1 WXVL_AK0084SB0168 [0,1,0,0,1,0|1,0,1]=4 232 B11R1.86 CC(=O)Nc1ccccc1Br WXVL_AG00180SB0150 [0,1,0,0,1,0|2,0,0]=4 233 B11R1.86 CC(=O)Nc1ccccc1Br WXVL_AG00180SB0150 [0,1,0,0,1,0|2,0,0]=4 234 B11R1.86 CC(=O)Nc1ccccc1C WXVL_AG0027SB0150 [0,1,0,0,1,0|2,0,0]=4 235 B11R1.86 CC(=O)Nc1ccccc1C WXVL_AG0027SB0150 [0,1,0,0,1,0|2,0,0]=4 236 B11R1.86 CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0150 [0,1,0,0,1,0|2,0,0]=4 237 B11R1.86 CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0150 [0,1,0,0,1,0|2,0,0]=4 238 B11R1.86 CC(=O)Nc1ccccc1I WXVL_AG0385SB0150 [0,1,0,0,1,0|2,0,0]=4 239 B11R1.86 CC(=O)Nc1ccccc1I WXVL_AG0385SB0150 [0,1,0,0,1,0|2,0,0]=4 240 B11R1.86 Cc1ccccc1CC(=O)N WXVL_AK0084SB0098 [0,1,0,0,1,0|1,0,1]=4 241 B11R1.86 Cc1ccccc1CC(=O)N WXVL_AK0084SB0098 [0,1,0,0,1,0|1,0,1]=4 242 B11R1.86 NC(=O)Cc1ccccc1Br WXVL_AK0084SB0093 [0,1,0,0,1,0|1,0,1]=4 243 B11R1.86 NC(=O)Cc1ccccc1Br WXVL_AK0084SB0093 [0,1,0,0,1,0|1,0,1]=4 244 B11R1.86 NC(=O)Cc1ccccc1Cl WXVL_AK0084SB0095 [0,1,0,0,1,0|1,0,1]=4 245 B11R1.86 NC(=O)Cc1ccccc1Cl WXVL_AK0084SB0095 [0,1,0,0,1,0|1,0,1]=4 246 B11R1.86 NC(=O)Cc1ccccc1F WXVL_AK0084SB0094 [0,1,0,0,1,0|1,0,1]=4 247 B11R1.86 NC(=O)Cc1ccccc1F WXVL_AK0084SB0094 [0,1,0,0,1,0|1,0,1]=4 248 B11R1.86 NC(=O)Cc1ccccc1I WXVL_AK0084SB1145 [0,1,0,0,1,0|1,0,1]=4 249 B11R1.86 NC(=O)Cc1ccccc1I WXVL_AK0084SB1145 [0,1,0,0,1,0|1,0,1]=4 250 B11R1.86 NC(=O)Cc1ccccc1O WXVL_AK0084SB0400 [0,1,0,0,1,0|1,0,1]=4 251 B11R1.86 NC(=O)Cc1ccccc1O WXVL_AK0084SB0400 [0,1,0,0,1,0|1,0,1]=4 252 B11R1.157 CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0150 [0,1,0,0,1,0|2,0,0]=4 253 B11R1.157 CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0150 [0,1,0,0,1,0|2,0,0]=4 254 B11R1.157 CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0150 [0,1,0,0,1,0|2,0,0]=4 255 B11R1.157 CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0150 [0,1,0,0,1,0|2,0,0]=4 256 B11R1.157 CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0150 [0,1,0,0,1,0|2,0,0]=4 257 B11R1.157 CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0150 [0,1,0,0,1,0|2,0,0]=4 258 B11R1.157 Cc1cccc(c1)CC(=O)N WXVL_AK0084SB0105 [0,1,0,0,1,0|1,0,1]=4 259 B11R1.157 Cc1cccc(c1)CC(=O)N WXVL_AK0084SB0105 [0,1,0,0,1,0|1,0,1]=4 260 B11R1.157 NC(=O)Cc1cccc(c1)Br WXVL_AK0084SB0099 [0,1,0,0,1,0|1,0,1]=4 261 B11R1.157 NC(=O)Cc1cccc(c1)Br WXVL_AK0084SB0099 [0,1,0,0,1,0|1,0,1]=4 262 B11R1.157 NC(=O)Cc1cccc(c1)Cl WXVL_AK0084SB0101 [0,1,0,0,1,0|1,0,1]=4 263 B11R1.157 NC(=O)Cc1cccc(c1)Cl WXVL_AK0084SB0101 [0,1,0,0,1,0|1,0,1]=4 264 B11R1.157 NC(=O)Cc1cccc(c1)F WXVL_AK0084SB0100 [0,1,0,0,1,0|1,0,1]=4 265 B11R1.157 NC(=O)Cc1cccc(c1)F WXVL_AK0084SB0100 [0,1,0,0,1,0|1,0,1]=4 266 B11R1.157 NC(=O)Cc1cccc(c1)O WXVL_AK0084SB0104 [0,1,0,0,1,0|1,0,1]=4 267 B11R1.157 NC(=O)Cc1cccc(c1)O WXVL_AK0084SB0104 [0,1,0,0,1,0|1,0,1]=4 268 B11R1.25 CNC(=O)/C=C/c1ccco1 WXVL_AK00442SA0180 [0,1,0,0,1,0|2,0,0]=4 269 B11R1.25 CNC(=O)/C=C/c1ccco1 WXVL_AK00442SA0180 [0,1,0,0,1,0|2,0,0]=4 270 B11R1.25 CNC(=O)/C=C/c1cccs1 WXVL_AK00442SA0001 [0,1,0,0,1,0|2,0,0]=4 271 B11R1.25 CNC(=O)/C=C/c1cccs1 WXVL_AK00442SA0001 [0,1,0,0,1,0|2,0,0]=4 272 B11R1.25 CNC(=O)/C=C/c1ccoc1 WXVL_AK00442SA0047 [0,1,0,0,1,0|2,0,0]=4 273 B11R1.25 CNC(=O)/C=C/c1ccoc1 WXVL_AK00442SA0047 [0,1,0,0,1,0|2,0,0]=4 274 B11R1.25 CNC(=O)/C=C/c1ccsc1 WXVL_AK00442SA0251 [0,1,0,0,1,0|2,0,0]=4 275 B11R1.25 CNC(=O)/C=C/c1ccsc1 WXVL_AK00442SA0251 [0,1,0,0,1,0|2,0,0]=4 276 B11R1.75 Cc1ccc(s1)/C=C/C(=O)N WXVL_AK0084SA1334 [0,1,0,0,1,0|2,0,0]=4 277 B11R1.75 Cc1ccc(s1)/C=C/C(=O)N WXVL_AK0084SA1334 [0,1,0,0,1,0|2,0,0]=4 278 B13R1.45 NC(=O)CNC(=O)c1ccccc1 WXVL_AK0084SB0466 [0,1,0,0,0,1|1,0,1]=4 279 B13R1.45 NC(=O)CNC(=O)c1ccccc1 WXVL_AK0084SB0466 [0,1,0,0,0,1|1,0,1]=4 280 B13R1.45 NC(=O)CNC(=O)c1ccccc1 WXVL_AK0147SD0001 [0,1,0,0,0,1|1,0,1]=4 281 B13R1.45 NC(=O)CNC(=O)c1ccccc1 WXVL_AK0147SD0001 [0,1,0,0,0,1|1,0,1]=4 282 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,1,0,0,0,1|2,0,0]=4 283 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,1,0,0,0,1|2,0,0]=4 284 B13R1.351 CC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0051 [0,1,0,0,0,1|1,0,1]=4 285 B13R1.351 CC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0051 [0,1,0,0,0,1|1,0,1]=4 286 B13R1.351 NC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0128 [0,1,0,0,0,1|1,0,1]=4 287 B13R1.351 NC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0128 [0,1,0,0,0,1|1,0,1]=4 288 B13R1.718 O=C(CO)NCCc1ccccc1 WXVL_AK00498SB2706 [0,1,0,0,0,1|0,0,2]=4 289 B13R1.718 O=C(CO)NCCc1ccccc1 WXVL_AK00498SB2706 [0,1,0,0,0,1|0,0,2]=4 290 B13R1.3 COc1ccc(cc1)/C=C/C(=O)N WXVL_AK0084SB0120 [0,2,0,0,0,0|1,0,0]=3 291 B13R1.3 COc1ccc(cc1)/C=C/C(=O)N WXVL_AK0084SB0120 [0,2,0,0,0,0|1,0,0]=3 292 B13R1.14 CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00442SB0418 [0,2,0,0,0,0|1,0,0]=3 293 B13R1.14 CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00442SB0418 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00442SB1122 [0,2,0,0,0,0|1,0,0]=3 295 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00442SB1122 [0,2,0,0,0,0|1,0,0]=3 296 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C WXVL_AK00442SB0060 [0,2,0,0,0,0|1,0,0]=3 297 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C WXVL_AK00442SB0060 [0,2,0,0,0,0|1,0,0]=3 298 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00442SB0119 [0,2,0,0,0,0|1,0,0]=3 299 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00442SB0119 [0,2,0,0,0,0|1,0,0]=3 300 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F WXVL_AK00442SB1186 [0,2,0,0,0,0|1,0,0]=3 301 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F WXVL_AK00442SB1186 [0,2,0,0,0,0|1,0,0]=3 302 B13R1.14 Cc1ccc(cc1)CNC(=O)CO WXVL_AK0048SB2706 [0,2,0,0,0,0|1,0,1]=4 303 B13R1.14 Cc1ccc(cc1)CNC(=O)CO WXVL_AK0048SB2706 [0,2,0,0,0,0|1,0,1]=4 304 B13R1.14 O=C(CO)NCc1ccc(cc1)Br WXVL_AK1474SB2706 [0,2,0,0,0,0|1,0,1]=4 305 B13R1.14 O=C(CO)NCc1ccc(cc1)Br WXVL_AK1474SB2706 [0,2,0,0,0,0|1,0,1]=4 306 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl WXVL_AK0047SB2706 [0,2,0,0,0,0|1,0,1]=4 307 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl WXVL_AK0047SB2706 [0,2,0,0,0,0|1,0,1]=4 308 B13R1.14 O=C(CO)NCc1ccc(cc1)F WXVL_AK0046SB2706 [0,2,0,0,0,0|1,0,1]=4 309 B13R1.14 O=C(CO)NCc1ccc(cc1)F WXVL_AK0046SB2706 [0,2,0,0,0,0|1,0,1]=4 310 B13R1.14 O=C(CO)NCc1ccc(cc1)I WXVL_AK1644SB2706 [0,2,0,0,0,0|1,0,1]=4 311 B13R1.14 O=C(CO)NCc1ccc(cc1)I WXVL_AK1644SB2706 [0,2,0,0,0,0|1,0,1]=4 312 B13R1.14 O=C(CO)NCc1ccc(cc1)O WXVL_AK0926SB2706 [0,2,0,0,0,0|1,0,1]=4 313 B13R1.14 O=C(CO)NCc1ccc(cc1)O WXVL_AK0926SB2706 [0,2,0,0,0,0|1,0,1]=4 314 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0051 [0,2,0,0,0,0|2,0,0]=4 315 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0051 [0,2,0,0,0,0|2,0,0]=4 316 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0051 [0,2,0,0,0,0|2,0,0]=4 317 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0051 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.133 NC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK0084SB2710 [0,2,0,0,0,0|1,0,1]=4 319 B13R1.133 NC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK0084SB2710 [0,2,0,0,0,0|1,0,1]=4 320 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0128 [0,2,0,0,0,0|2,0,0]=4 321 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0128 [0,2,0,0,0,0|2,0,0]=4 322 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0128 [0,2,0,0,0,0|2,0,0]=4 323 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0128 [0,2,0,0,0,0|2,0,0]=4 324 B13R1.164 NC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK0084SB5557 [0,2,0,0,0,0|1,0,0]=3 325 B13R1.164 NC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK0084SB5557 [0,2,0,0,0,0|1,0,0]=3 326 B13R1.164 NC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK0084SB8094 [0,2,0,0,0,0|1,0,0]=3 327 B13R1.164 NC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK0084SB8094 [0,2,0,0,0,0|1,0,0]=3 328 B13R1.164 NC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK0084SB1318 [0,2,0,0,0,0|1,0,0]=3 329 B13R1.164 NC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK0084SB1318 [0,2,0,0,0,0|1,0,0]=3 330 B13R1.164 NC(=O)/C=C/c1ccc(cc1F)F WXVL_AK0084SB1257 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.164 NC(=O)/C=C/c1ccc(cc1F)F WXVL_AK0084SB1257 [0,2,0,0,0,0|1,0,0]=3 332 B13R1.164 NC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK0084SB0256 [0,2,0,0,0,0|1,0,0]=3 333 B13R1.164 NC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK0084SB0256 [0,2,0,0,0,0|1,0,0]=3 334 B13R1.164 NC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK0084SB3115 [0,2,0,0,0,0|1,0,0]=3 335 B13R1.164 NC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK0084SB3115 [0,2,0,0,0,0|1,0,0]=3 336 B13R1.164 NC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK0084SB0235 [0,2,0,0,0,0|1,0,0]=3 337 B13R1.164 NC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK0084SB0235 [0,2,0,0,0,0|1,0,0]=3 338 B13R1.511 NC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK0084SB0118 [0,2,0,0,0,0|1,0,0]=3 339 B13R1.511 NC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK0084SB0118 [0,2,0,0,0,0|1,0,0]=3 340 B13R1.11 CNC(=O)NC(=O)c1ccccc1 WXVL_AK00442YV0027 [0,2,0,0,0,0|2,0,0]=4 341 B13R1.11 CNC(=O)NC(=O)c1ccccc1 WXVL_AK00442YV0027 [0,2,0,0,0,0|2,0,0]=4 342 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00442SB1601 [0,2,0,0,0,0|1,0,0]=3 343 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00442SB1601 [0,2,0,0,0,0|1,0,0]=3 344 B13R1.15 CNC(=O)C=Cc1cccc(c1)O WXVL_AK00442SB0417 [0,2,0,0,0,0|1,0,0]=3 345 B13R1.15 CNC(=O)C=Cc1cccc(c1)O WXVL_AK00442SB0417 [0,2,0,0,0,0|1,0,0]=3 346 B13R1.15 Cc1cccc(c1)CNC(=O)CO WXVL_AK0045SB2706 [0,2,0,0,0,0|1,0,1]=4 347 B13R1.15 Cc1cccc(c1)CNC(=O)CO WXVL_AK0045SB2706 [0,2,0,0,0,0|1,0,1]=4 348 B13R1.15 O=C(CO)NCc1cccc(c1)Br WXVL_AK1177SB2706 [0,2,0,0,0,0|1,0,1]=4 349 B13R1.15 O=C(CO)NCc1cccc(c1)Br WXVL_AK1177SB2706 [0,2,0,0,0,0|1,0,1]=4 350 B13R1.15 O=C(CO)NCc1cccc(c1)Cl WXVL_AK0094SB2706 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.15 O=C(CO)NCc1cccc(c1)Cl WXVL_AK0094SB2706 [0,2,0,0,0,0|1,0,1]=4 352 B13R1.15 O=C(CO)NCc1cccc(c1)F WXVL_AK0041SB2706 [0,2,0,0,0,0|1,0,1]=4 353 B13R1.15 O=C(CO)NCc1cccc(c1)F WXVL_AK0041SB2706 [0,2,0,0,0,0|1,0,1]=4 354 B13R1.15 O=C(CO)NCc1cccc(c1)I WXVL_AK1572SB2706 [0,2,0,0,0,0|1,0,1]=4 355 B13R1.15 O=C(CO)NCc1cccc(c1)I WXVL_AK1572SB2706 [0,2,0,0,0,0|1,0,1]=4 356 B13R1.15 O=C(CO)NCc1cccc(c1)O WXVL_AK0974SB2706 [0,2,0,0,0,0|1,0,1]=4 357 B13R1.15 O=C(CO)NCc1cccc(c1)O WXVL_AK0974SB2706 [0,2,0,0,0,0|1,0,1]=4 358 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [0,2,0,0,0,0|1,0,0]=3 359 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [0,2,0,0,0,0|1,0,0]=3 360 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [0,2,0,0,0,0|2,0,0]=4 361 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [0,2,0,0,0,0|2,0,0]=4 362 B13R1.42 COCC(=O)NCc1ccccc1 WXVL_AK00502SB0090 [0,2,0,0,0,0|1,0,1]=4 363 B13R1.42 COCC(=O)NCc1ccccc1 WXVL_AK00502SB0090 [0,2,0,0,0,0|1,0,1]=4 364 B13R1.135 C=C(Cc1ccccc1)C(=O)NC WXVL_AK00442SB0413 [0,2,0,0,0,0|1,0,1]=4 365 B13R1.135 C=C(Cc1ccccc1)C(=O)NC WXVL_AK00442SB0413 [0,2,0,0,0,0|1,0,1]=4 366 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0344 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0344 [0,2,0,0,0,0|2,0,0]=4 368 B13R1.135 CN(Cc1ccccc1)C(=O)CO WXVL_AN0033SB2706 [0,2,0,0,0,0|1,0,1]=4 369 B13R1.135 CN(Cc1ccccc1)C(=O)CO WXVL_AN0033SB2706 [0,2,0,0,0,0|1,0,1]=4 370 B13R1.135 CNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00442SA1933 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.135 CNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00442SA1933 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.254 CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00442HU0026 [0,2,0,0,0,0|1,0,1]=4 373 B13R1.254 CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00442HU0026 [0,2,0,0,0,0|1,0,1]=4 374 B13R1.528 CNC(=O)C=Cc1ccccc1Br WXVL_AK00442SB3065 [0,2,0,0,0,0|1,0,0]=3 375 B13R1.528 CNC(=O)C=Cc1ccccc1Br WXVL_AK00442SB3065 [0,2,0,0,0,0|1,0,0]=3 376 B13R1.528 Cc1ccccc1CNC(=O)CO WXVL_AK0040SB2706 [0,2,0,0,0,0|1,0,1]=4 377 B13R1.528 Cc1ccccc1CNC(=O)CO WXVL_AK0040SB2706 [0,2,0,0,0,0|1,0,1]=4 378 B13R1.528 O=C(CO)NCc1ccccc1Br WXVL_AK1632SB2706 [0,2,0,0,0,0|1,0,1]=4 379 B13R1.528 O=C(CO)NCc1ccccc1Br WXVL_AK1632SB2706 [0,2,0,0,0,0|1,0,1]=4 380 B13R1.528 O=C(CO)NCc1ccccc1Cl WXVL_AK0038SB2706 [0,2,0,0,0,0|1,0,1]=4 381 B13R1.528 O=C(CO)NCc1ccccc1Cl WXVL_AK0038SB2706 [0,2,0,0,0,0|1,0,1]=4 382 B13R1.528 O=C(CO)NCc1ccccc1F WXVL_AK0037SB2706 [0,2,0,0,0,0|1,0,1]=4 383 B13R1.528 O=C(CO)NCc1ccccc1F WXVL_AK0037SB2706 [0,2,0,0,0,0|1,0,1]=4 384 B13R1.528 O=C(CO)NCc1ccccc1I WXVL_AK3923SB2706 [0,2,0,0,0,0|1,0,1]=4 385 B13R1.528 O=C(CO)NCc1ccccc1I WXVL_AK3923SB2706 [0,2,0,0,0,0|1,0,1]=4 386 B13R1.528 O=C(CO)NCc1ccccc1O WXVL_AK0963SB2706 [0,2,0,0,0,0|1,0,1]=4 387 B13R1.528 O=C(CO)NCc1ccccc1O WXVL_AK0963SB2706 [0,2,0,0,0,0|1,0,1]=4 388 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)C WXVL_AG0052SB0051 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)C WXVL_AG0052SB0051 [0,2,0,0,0,0|2,0,0]=4 390 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB0051 [0,2,0,0,0,0|2,0,0]=4 391 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB0051 [0,2,0,0,0,0|2,0,0]=4 392 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB0051 [0,2,0,0,0,0|2,0,0]=4 393 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB0051 [0,2,0,0,0,0|2,0,0]=4 394 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)N WXVL_AG0052SB0128 [0,2,0,0,0,0|2,0,0]=4 395 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)N WXVL_AG0052SB0128 [0,2,0,0,0,0|2,0,0]=4 396 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB0128 [0,2,0,0,0,0|2,0,0]=4 397 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB0128 [0,2,0,0,0,0|2,0,0]=4 398 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB0128 [0,2,0,0,0,0|2,0,0]=4 399 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB0128 [0,2,0,0,0,0|2,0,0]=4 400 B13R1.202 CC(=O)C(=O)Nc1ccccc1Br WXVL_AG00180SB0051 [0,2,0,0,0,0|2,0,0]=4 401 B13R1.202 CC(=O)C(=O)Nc1ccccc1Br WXVL_AG00180SB0051 [0,2,0,0,0,0|2,0,0]=4 402 B13R1.202 CC(=O)C(=O)Nc1ccccc1C WXVL_AG0027SB0051 [0,2,0,0,0,0|2,0,0]=4 403 B13R1.202 CC(=O)C(=O)Nc1ccccc1C WXVL_AG0027SB0051 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0051 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0051 [0,2,0,0,0,0|2,0,0]=4 406 B13R1.202 CC(=O)C(=O)Nc1ccccc1I WXVL_AG0385SB0051 [0,2,0,0,0,0|2,0,0]=4 407 B13R1.202 CC(=O)C(=O)Nc1ccccc1I WXVL_AG0385SB0051 [0,2,0,0,0,0|2,0,0]=4 408 B13R1.202 Cc1ccccc1NC(=O)C(=O)N WXVL_AG0027SB0128 [0,2,0,0,0,0|2,0,0]=4 409 B13R1.202 Cc1ccccc1NC(=O)C(=O)N WXVL_AG0027SB0128 [0,2,0,0,0,0|2,0,0]=4 410 B13R1.202 NC(=O)C(=O)Nc1ccccc1Br WXVL_AG00180SB0128 [0,2,0,0,0,0|2,0,0]=4 411 B13R1.202 NC(=O)C(=O)Nc1ccccc1Br WXVL_AG00180SB0128 [0,2,0,0,0,0|2,0,0]=4 412 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0128 [0,2,0,0,0,0|2,0,0]=4 413 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB0128 [0,2,0,0,0,0|2,0,0]=4 414 B13R1.202 NC(=O)C(=O)Nc1ccccc1I WXVL_AG0385SB0128 [0,2,0,0,0,0|2,0,0]=4 415 B13R1.202 NC(=O)C(=O)Nc1ccccc1I WXVL_AG0385SB0128 [0,2,0,0,0,0|2,0,0]=4 416 B13R1.643 COc1cccc(c1)C=CC(=O)N WXVL_AK0084SB0458 [0,2,0,0,0,0|1,0,0]=3 417 B13R1.643 COc1cccc(c1)C=CC(=O)N WXVL_AK0084SB0458 [0,2,0,0,0,0|1,0,0]=3 418 B13R1.643 N#Cc1cccc(c1)/C=C/C(=O)N WXVL_AK0084SB2454 [0,2,0,0,0,0|1,0,0]=3 419 B13R1.643 N#Cc1cccc(c1)/C=C/C(=O)N WXVL_AK0084SB2454 [0,2,0,0,0,0|1,0,0]=3 420 B13R1.3420 NC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK0084SB1124 [0,2,0,0,0,0|1,0,0]=3 421 B13R1.3420 NC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK0084SB1124 [0,2,0,0,0,0|1,0,0]=3 422 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT0919 [0,0,0,1,0,1|1,1,0]=4 423 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT1115 [0,0,0,1,0,1|1,1,0]=4 424 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT2957 [0,0,0,1,0,1|1,1,0]=4 425 B13R2.10 Cc1cnc([nH]1)c2ccccc2 WXVL_LR1156BT0919 [0,0,0,1,0,1|2,0,0]=4 426 B13R2.10 Cc1cnc([nH]1)c2ccccc2 WXVL_LR1156BT1115 [0,0,0,1,0,1|2,0,0]=4 427 B13R2.10 Cc1cnc([nH]1)c2ccccc2 WXVL_LR1156BT2957 [0,0,0,1,0,1|2,0,0]=4 428 B13R2.10 Cc1ncc(s1)c2ccccc2 WXVL_LR0558BT0919 [0,0,0,1,0,1|1,1,0]=4 429 B13R2.10 Cc1ncc(s1)c2ccccc2 WXVL_LR0558BT1115 [0,0,0,1,0,1|1,1,0]=4 430 B13R2.10 Cc1ncc(s1)c2ccccc2 WXVL_LR0558BT2957 [0,0,0,1,0,1|1,1,0]=4 431 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT0919 [0,0,0,1,0,1|2,0,0]=4 432 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT1115 [0,0,0,1,0,1|2,0,0]=4 433 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT2957 [0,0,0,1,0,1|2,0,0]=4 434 B13R2.10 Clc1cc(cs1)c2ccccc2 WXVL_LR0844BT0919 [0,0,0,1,0,1|2,0,0]=4 435 B13R2.10 Clc1cc(cs1)c2ccccc2 WXVL_LR0844BT1115 [0,0,0,1,0,1|2,0,0]=4 436 B13R2.10 Clc1cc(cs1)c2ccccc2 WXVL_LR0844BT2957 [0,0,0,1,0,1|2,0,0]=4 437 B13R2.10 Clc1ccc(s1)c2ccccc2 WXVL_LR0493BT0919 [0,0,0,1,0,1|1,1,0]=4 438 B13R2.10 Clc1ccc(s1)c2ccccc2 WXVL_LR0493BT1115 [0,0,0,1,0,1|1,1,0]=4 439 B13R2.10 Clc1ccc(s1)c2ccccc2 WXVL_LR0493BT2957 [0,0,0,1,0,1|1,1,0]=4 440 B13R2.10 Clc1csc(n1)c2ccccc2 WXVL_LR1009BT0919 [0,0,0,1,0,1|2,0,0]=4 441 B13R2.10 Clc1csc(n1)c2ccccc2 WXVL_LR1009BT1115 [0,0,0,1,0,1|2,0,0]=4 442 B13R2.10 Clc1csc(n1)c2ccccc2 WXVL_LR1009BT2957 [0,0,0,1,0,1|2,0,0]=4 443 B13R2.10 Clc1ncc(s1)c2ccccc2 WXVL_LR1248BT0919 [0,0,0,1,0,1|1,1,0]=4 444 B13R2.10 Clc1ncc(s1)c2ccccc2 WXVL_LR1248BT1115 [0,0,0,1,0,1|1,1,0]=4 445 B13R2.10 Clc1ncc(s1)c2ccccc2 WXVL_LR1248BT2957 [0,0,0,1,0,1|1,1,0]=4 446 B13R2.10 Fc1cnc(s1)c2ccccc2 WXVL_LR1252BT0919 [0,0,0,1,0,1|1,1,0]=4 447 B13R2.10 Fc1cnc(s1)c2ccccc2 WXVL_LR1252BT1115 [0,0,0,1,0,1|1,1,0]=4 448 B13R2.10 Fc1cnc(s1)c2ccccc2 WXVL_LR1252BT2957 [0,0,0,1,0,1|1,1,0]=4 449 B13R2.72 NC(=O)c1c[nH]c2c1cccn2 WXVL_AK0084SE0048 [0,0,0,1,0,1|2,0,0]=4 450 B13R2.72 NC(=O)c1c[nH]c2c1cccn2 WXVL_AK0084SE0048 [0,0,0,1,0,1|2,0,0]=4 451 B13R2.72 NC(=O)c1c[nH]c2c1ccnc2 WXVL_AK0084SE0638 [0,0,0,1,0,1|2,0,0]=4 452 B13R2.72 NC(=O)c1c[nH]c2c1ccnc2 WXVL_AK0084SE0638 [0,0,0,1,0,1|2,0,0]=4 453 B13R2.72 NC(=O)c1cnc2n1cccc2 WXVL_AK0084SE0102 [0,0,0,1,0,1|2,0,0]=4 454 B13R2.72 NC(=O)c1cnc2n1cccc2 WXVL_AK0084SE0102 [0,0,0,1,0,1|2,0,0]=4 455 B13R2.72 NC(=O)c1cnn2c1cccc2 WXVL_AK0084SE0033 [0,0,0,1,0,1|2,0,0]=4 456 B13R2.72 NC(=O)c1cnn2c1cccc2 WXVL_AK0084SE0033 [0,0,0,1,0,1|2,0,0]=4 457 B13R2.72 NC(=O)c1coc2c1cccc2 WXVL_AK0084SE0302 [0,0,0,1,0,1|1,0,0]=3 458 B13R2.72 NC(=O)c1coc2c1cccc2 WXVL_AK0084SE0302 [0,0,0,1,0,1|1,0,0]=3 459 B13R2.72 NC(=O)c1csc2c1cccc2 WXVL_AK0084SE0108 [0,0,0,1,0,1|1,0,0]=3 460 B13R2.72 NC(=O)c1csc2c1cccc2 WXVL_AK0084SE0108 [0,0,0,1,0,1|1,0,0]=3 461 B13R2.72 NC(=O)c1n[nH]c2c1cccc2 WXVL_AK0084SE0379 [0,0,0,1,0,1|2,0,0]=4 462 B13R2.72 NC(=O)c1n[nH]c2c1cccc2 WXVL_AK0084SE0379 [0,0,0,1,0,1|2,0,0]=4 463 B13R2.72 NC(=O)c1onc2c1cccc2 WXVL_AK0084SE0896 [0,0,0,1,0,1|2,0,0]=4 464 B13R2.72 NC(=O)c1onc2c1cccc2 WXVL_AK0084SE0896 [0,0,0,1,0,1|2,0,0]=4 465 B13R2.435 NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0084SE0001 [0,1,0,1,0,0|1,0,0]=3 466 B13R2.435 NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0084SE0001 [0,1,0,1,0,0|1,0,0]=3 467 B13R2.435 NC(=O)c1cc2ccccc2o1 WXVL_AK0084SE0105 [0,1,0,1,0,0|1,0,0]=3 468 B13R2.435 NC(=O)c1cc2ccccc2o1 WXVL_AK0084SE0105 [0,1,0,1,0,0|1,0,0]=3 469 B13R2.435 NC(=O)c1cc2ccccc2s1 WXVL_AK0084SE0107 [0,1,0,1,0,0|1,0,0]=3 470 B13R2.435 NC(=O)c1cc2ccccc2s1 WXVL_AK0084SE0107 [0,1,0,1,0,0|1,0,0]=3 471 B13R2.435 NC(=O)c1cc2ccccn2n1 WXVL_AK0084SE0030 [0,1,0,1,0,0|2,0,0]=4 472 B13R2.435 NC(=O)c1cc2ccccn2n1 WXVL_AK0084SE0030 [0,1,0,1,0,0|2,0,0]=4 473 B13R2.435 NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0084SE0450 [0,1,0,1,0,0|2,0,0]=4 474 B13R2.435 NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0084SE0450 [0,1,0,1,0,0|2,0,0]=4 475 B13R2.435 NC(=O)c1cc2cccnc2s1 WXVL_AK0084SE0061 [0,1,0,1,0,0|2,0,0]=4 476 B13R2.435 NC(=O)c1cc2cccnc2s1 WXVL_AK0084SE0061 [0,1,0,1,0,0|2,0,0]=4 477 B13R2.435 NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0084SE0511 [0,1,0,1,0,0|2,0,0]=4 478 B13R2.435 NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0084SE0511 [0,1,0,1,0,0|2,0,0]=4 479 B13R2.435 NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0084SE0680 [0,1,0,1,0,0|2,0,0]=4 480 B13R2.435 NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0084SE0680 [0,1,0,1,0,0|2,0,0]=4 481 B13R2.435 NC(=O)c1nc2ccccc2[nH]1 WXVL_AK0084SE0026 [0,1,0,1,0,0|2,0,0]=4 482 B13R2.435 NC(=O)c1nc2ccccc2[nH]1 WXVL_AK0084SE0026 [0,1,0,1,0,0|2,0,0]=4 483 B13R2.435 NC(=O)c1nc2ccccc2o1 WXVL_AK0084SE0704 [0,1,0,1,0,0|2,0,0]=4 484 B13R2.435 NC(=O)c1nc2ccccc2o1 WXVL_AK0084SE0704 [0,1,0,1,0,0|2,0,0]=4 485 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [0,0,0,0,2,0|1,0,0]=3 486 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [0,0,0,0,2,0|1,0,0]=3 487 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [0,0,0,0,2,0|2,0,0]=4 488 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [0,0,0,0,2,0|2,0,0]=4 489 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [0,0,0,0,2,0|2,0,0]=4 490 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [0,0,0,0,2,0|2,0,0]=4 491 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [0,0,0,0,2,0|2,0,0]=4 492 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [0,0,0,0,2,0|2,0,0]=4 493 B13R1.337 CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0150 [0,0,0,0,0,2|1,0,0]=3 494 B13R1.337 CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0150 [0,0,0,0,0,2|1,0,0]=3