0 B12R1.107 CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0150 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.107 CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0150 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.107 CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0150 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.107 CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0150 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.107 CC(=O)NC(C)c1cnccn1 WXVL_AK2765SB0150 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.107 CC(=O)NC(C)c1cnccn1 WXVL_AK2765SB0150 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.107 CC(=O)NC(C)c1cncnc1 WXVL_AK2107SB0150 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.107 CC(=O)NC(C)c1cncnc1 WXVL_AK2107SB0150 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0150 [0,0,0,0,0,0|2,0,0]=2 9 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0150 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0150 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0150 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0150 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0150 [0,0,0,0,0,0|2,0,0]=2 14 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0150 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0150 [0,0,0,0,0,0|2,0,0]=2 16 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,0,0,0,0,0|2,0,0]=2 17 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,0,0,0,0,0|2,0,0]=2 18 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [1,0,0,0,0,0|1,0,0]=2 22 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [1,0,0,0,0,0|2,0,0]=3 28 B11R1.91 CC(=O)NCc1ccncn1 WXVL_AK1356SB0150 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.91 CC(=O)NCc1ccncn1 WXVL_AK1356SB0150 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.91 CC(=O)NCc1cnccn1 WXVL_AK00262SB0150 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.91 CC(=O)NCc1cnccn1 WXVL_AK00262SB0150 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.91 CC(=O)NCc1cncnc1 WXVL_AK1364SB0150 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.91 CC(=O)NCc1cncnc1 WXVL_AK1364SB0150 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.91 CC(=O)NCc1ncccn1 WXVL_AK0279SB0150 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.91 CC(=O)NCc1ncccn1 WXVL_AK0279SB0150 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [1,0,0,0,0,0|2,0,1]=4 39 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [1,0,0,0,0,0|3,0,0]=4 44 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [1,0,0,0,0,0|3,0,0]=4 45 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [1,0,0,0,0,0|3,0,0]=4 46 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [1,0,0,0,0,0|3,0,0]=4 47 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.11 C#CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0338 [0,1,0,0,0,0|2,0,1]=4 51 B13R1.11 C#CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0338 [0,1,0,0,0,0|2,0,1]=4 52 B13R1.11 C#CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0338 [0,1,0,0,0,0|2,0,1]=4 53 B13R1.11 C#CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0338 [0,1,0,0,0,0|2,0,1]=4 54 B13R1.11 C#CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0338 [0,1,0,0,0,0|2,0,1]=4 55 B13R1.11 C#CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0338 [0,1,0,0,0,0|2,0,1]=4 56 B13R1.11 C#CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0338 [0,1,0,0,0,0|2,0,1]=4 57 B13R1.11 C#CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0338 [0,1,0,0,0,0|2,0,1]=4 58 B13R1.11 C#CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0338 [0,1,0,0,0,0|2,0,1]=4 59 B13R1.11 C#CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0338 [0,1,0,0,0,0|2,0,1]=4 60 B13R1.11 C#CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0338 [0,1,0,0,0,0|2,0,1]=4 61 B13R1.11 C#CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0338 [0,1,0,0,0,0|2,0,1]=4 62 B13R1.11 CC(NC(=O)CO)c1ccccn1 WXVL_AK0585SB2706 [0,1,0,0,0,0|2,0,0]=3 63 B13R1.11 CC(NC(=O)CO)c1ccccn1 WXVL_AK0585SB2706 [0,1,0,0,0,0|2,0,0]=3 64 B13R1.11 CC(NC(=O)CO)c1ccncc1 WXVL_AK0282SB2706 [0,1,0,0,0,0|2,0,0]=3 65 B13R1.11 CC(NC(=O)CO)c1ccncc1 WXVL_AK0282SB2706 [0,1,0,0,0,0|2,0,0]=3 66 B13R1.11 CC(NC(=O)CO)c1cnccn1 WXVL_AK2765SB2706 [0,1,0,0,0,0|3,0,0]=4 67 B13R1.11 CC(NC(=O)CO)c1cnccn1 WXVL_AK2765SB2706 [0,1,0,0,0,0|3,0,0]=4 68 B13R1.11 CC(NC(=O)CO)c1cncnc1 WXVL_AK2107SB2706 [0,1,0,0,0,0|3,0,0]=4 69 B13R1.11 CC(NC(=O)CO)c1cncnc1 WXVL_AK2107SB2706 [0,1,0,0,0,0|3,0,0]=4 70 B13R1.11 CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0064 [0,1,0,0,0,0|2,0,0]=3 71 B13R1.11 CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0064 [0,1,0,0,0,0|2,0,0]=3 72 B13R1.11 CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0064 [0,1,0,0,0,0|2,0,0]=3 73 B13R1.11 CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0064 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.11 CCC(=O)NC(C)c1cnccn1 WXVL_AK2765SB0064 [0,1,0,0,0,0|3,0,0]=4 75 B13R1.11 CCC(=O)NC(C)c1cnccn1 WXVL_AK2765SB0064 [0,1,0,0,0,0|3,0,0]=4 76 B13R1.11 CCC(=O)NC(C)c1cncnc1 WXVL_AK2107SB0064 [0,1,0,0,0,0|3,0,0]=4 77 B13R1.11 CCC(=O)NC(C)c1cncnc1 WXVL_AK2107SB0064 [0,1,0,0,0,0|3,0,0]=4 78 B13R1.11 CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0064 [0,1,0,0,0,0|2,0,0]=3 79 B13R1.11 CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0064 [0,1,0,0,0,0|2,0,0]=3 80 B13R1.11 CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0064 [0,1,0,0,0,0|2,0,0]=3 81 B13R1.11 CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0064 [0,1,0,0,0,0|2,0,0]=3 82 B13R1.11 CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0064 [0,1,0,0,0,0|2,0,0]=3 83 B13R1.11 CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0064 [0,1,0,0,0,0|2,0,0]=3 84 B13R1.11 CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0064 [0,1,0,0,0,0|2,0,0]=3 85 B13R1.11 CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0064 [0,1,0,0,0,0|2,0,0]=3 86 B13R1.11 CNC(=O)CC(C)c1ccccc1 WXVL_AK00442SB0419 [0,1,0,0,0,0|1,0,0]=2 87 B13R1.11 CNC(=O)CC(C)c1ccccc1 WXVL_AK00442SB0419 [0,1,0,0,0,0|1,0,0]=2 88 B13R1.11 CNC(=O)CC(O)c1ccccc1 WXVL_AK00442SB2325 [0,1,0,0,0,0|2,0,0]=3 89 B13R1.11 CNC(=O)CC(O)c1ccccc1 WXVL_AK00442SB2325 [0,1,0,0,0,0|2,0,0]=3 90 B13R1.11 CNC(=O)NC(=O)c1ccccc1 WXVL_AK00442YV0027 [0,1,0,0,0,0|2,0,1]=4 91 B13R1.11 CNC(=O)NC(=O)c1ccccc1 WXVL_AK00442YV0027 [0,1,0,0,0,0|2,0,1]=4 92 B13R1.11 CNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00442YV0029 [0,1,0,0,0,0|1,0,0]=2 93 B13R1.11 CNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00442YV0029 [0,1,0,0,0,0|1,0,0]=2 94 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00442YV0061 [0,1,0,0,0,0|1,0,0]=2 95 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00442YV0061 [0,1,0,0,0,0|1,0,0]=2 96 B13R1.11 C[C@@H](NC(=O)CO)c1ccccn1 WXVL_AK1519SB2706 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.11 C[C@@H](NC(=O)CO)c1ccccn1 WXVL_AK1519SB2706 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.11 C[C@@H](NC(=O)CO)c1cccnc1 WXVL_AK00154SB2706 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.11 C[C@@H](NC(=O)CO)c1cccnc1 WXVL_AK00154SB2706 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.11 C[C@H](NC(=O)CO)c1ccccn1 WXVL_AK00388SB2706 [0,1,0,0,0,0|2,0,0]=3 101 B13R1.11 C[C@H](NC(=O)CO)c1ccccn1 WXVL_AK00388SB2706 [0,1,0,0,0,0|2,0,0]=3 102 B13R1.11 C[C@H](NC(=O)CO)c1cccnc1 WXVL_AK3888SB2706 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.11 C[C@H](NC(=O)CO)c1cccnc1 WXVL_AK3888SB2706 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.132 CC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0150 [0,1,0,0,0,0|1,0,0]=2 105 B13R1.132 CC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0150 [0,1,0,0,0,0|1,0,0]=2 106 B13R1.132 CC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0150 [0,1,0,0,0,0|1,0,0]=2 107 B13R1.132 CC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0150 [0,1,0,0,0,0|1,0,0]=2 108 B13R1.132 CC(=O)NC(C)c1ccc(cn1)Br WXVL_AK3272SB0150 [0,1,0,0,0,0|2,0,0]=3 109 B13R1.132 CC(=O)NC(C)c1ccc(cn1)Br WXVL_AK3272SB0150 [0,1,0,0,0,0|2,0,0]=3 110 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0150 [0,1,0,0,0,0|1,0,0]=2 111 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0150 [0,1,0,0,0,0|1,0,0]=2 112 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0150 [0,1,0,0,0,0|1,0,0]=2 113 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0150 [0,1,0,0,0,0|1,0,0]=2 114 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0150 [0,1,0,0,0,0|1,0,0]=2 115 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0150 [0,1,0,0,0,0|1,0,0]=2 116 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0150 [0,1,0,0,0,0|1,0,0]=2 117 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0150 [0,1,0,0,0,0|1,0,0]=2 118 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cn1)Br WXVL_AK00364SB0150 [0,1,0,0,0,0|2,0,0]=3 119 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cn1)Br WXVL_AK00364SB0150 [0,1,0,0,0,0|2,0,0]=3 120 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0150 [0,1,0,0,0,0|1,0,0]=2 121 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0150 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0150 [0,1,0,0,0,0|1,0,0]=2 123 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0150 [0,1,0,0,0,0|1,0,0]=2 124 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0150 [0,1,0,0,0,0|1,0,0]=2 125 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0150 [0,1,0,0,0,0|1,0,0]=2 126 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0150 [0,1,0,0,0,0|1,0,0]=2 127 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0150 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.132 CC(=O)N[C@H](C)c1ccc(cn1)Br WXVL_AK00397SB0150 [0,1,0,0,0,0|2,0,0]=3 129 B13R1.132 CC(=O)N[C@H](C)c1ccc(cn1)Br WXVL_AK00397SB0150 [0,1,0,0,0,0|2,0,0]=3 130 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0150 [0,1,0,0,0,0|1,0,0]=2 131 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0150 [0,1,0,0,0,0|1,0,0]=2 132 B13R1.147 CC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0150 [0,1,0,0,0,0|1,0,0]=2 133 B13R1.147 CC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0150 [0,1,0,0,0,0|1,0,0]=2 134 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0150 [0,1,0,0,0,0|1,0,0]=2 135 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0150 [0,1,0,0,0,0|1,0,0]=2 136 B13R1.147 CC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0150 [0,1,0,0,0,0|1,0,0]=2 137 B13R1.147 CC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0150 [0,1,0,0,0,0|1,0,0]=2 138 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0150 [0,1,0,0,0,0|1,0,0]=2 139 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0150 [0,1,0,0,0,0|1,0,0]=2 140 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0150 [0,1,0,0,0,0|1,0,0]=2 141 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0150 [0,1,0,0,0,0|1,0,0]=2 142 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0150 [0,1,0,0,0,0|1,0,0]=2 143 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0150 [0,1,0,0,0,0|1,0,0]=2 144 B13R1.152 CC(C(=O)N(C)C)c1ccccc1 WXVL_AN0032SB2326 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.152 CC(C(=O)N(C)C)c1ccccc1 WXVL_AN0032SB2326 [0,1,0,0,0,0|3,0,0]=4 146 B13R1.201 CC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0150 [0,1,0,0,0,0|1,0,0]=2 147 B13R1.201 CC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0150 [0,1,0,0,0,0|1,0,0]=2 148 B13R1.201 CC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0150 [0,1,0,0,0,0|1,0,0]=2 149 B13R1.201 CC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0150 [0,1,0,0,0,0|1,0,0]=2 150 B13R1.201 CC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0150 [0,1,0,0,0,0|1,0,0]=2 151 B13R1.201 CC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0150 [0,1,0,0,0,0|1,0,0]=2 152 B13R1.201 CC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0150 [0,1,0,0,0,0|1,0,0]=2 153 B13R1.201 CC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0150 [0,1,0,0,0,0|1,0,0]=2 154 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0150 [0,1,0,0,0,0|1,0,0]=2 155 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0150 [0,1,0,0,0,0|1,0,0]=2 156 B13R1.201 CC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0150 [0,1,0,0,0,0|1,0,0]=2 157 B13R1.201 CC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0150 [0,1,0,0,0,0|1,0,0]=2 158 B13R1.201 CC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0150 [0,1,0,0,0,0|1,0,0]=2 159 B13R1.201 CC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0150 [0,1,0,0,0,0|1,0,0]=2 160 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0150 [0,1,0,0,0,0|1,0,0]=2 161 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0150 [0,1,0,0,0,0|1,0,0]=2 162 B13R1.347 CC(=O)NC(C)(C)c1ccccn1 WXVL_AK3657SB0150 [0,1,0,0,0,0|2,0,0]=3 163 B13R1.347 CC(=O)NC(C)(C)c1ccccn1 WXVL_AK3657SB0150 [0,1,0,0,0,0|2,0,0]=3 164 B13R1.347 CC(=O)NC(C)(C)c1ccncc1 WXVL_AK4008SB0150 [0,1,0,0,0,0|2,0,0]=3 165 B13R1.347 CC(=O)NC(C)(C)c1ccncc1 WXVL_AK4008SB0150 [0,1,0,0,0,0|2,0,0]=3 166 B13R1.347 CC(C)(CC(=O)N)c1ccccc1 WXVL_AK0084SB0461 [0,1,0,0,0,0|2,0,0]=3 167 B13R1.347 CC(C)(CC(=O)N)c1ccccc1 WXVL_AK0084SB0461 [0,1,0,0,0,0|2,0,0]=3 168 B13R1.713 CC(=O)NC(C#N)c1ccccc1 WXVL_AK00665SB0150 [0,1,0,0,0,0|1,0,1]=3 169 B13R1.713 CC(=O)NC(C#N)c1ccccc1 WXVL_AK00665SB0150 [0,1,0,0,0,0|1,0,1]=3 170 B13R1.713 CC(=O)NC(CO)c1ccccn1 WXVL_AK00572SB0150 [0,1,0,0,0,0|2,0,0]=3 171 B13R1.713 CC(=O)NC(CO)c1ccccn1 WXVL_AK00572SB0150 [0,1,0,0,0,0|2,0,0]=3 172 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0150 [0,1,0,0,0,0|1,0,0]=2 173 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0150 [0,1,0,0,0,0|1,0,0]=2 174 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0150 [0,1,0,0,0,0|1,0,0]=2 175 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0150 [0,1,0,0,0,0|1,0,0]=2 176 B13R1.713 CCC(NC(=O)C)c1cccnc1 WXVL_AK00757SB0150 [0,1,0,0,0,0|2,0,0]=3 177 B13R1.713 CCC(NC(=O)C)c1cccnc1 WXVL_AK00757SB0150 [0,1,0,0,0,0|2,0,0]=3 178 B13R1.713 CCC(NC(=O)C)c1ccncc1 WXVL_AK2375SB0150 [0,1,0,0,0,0|2,0,0]=3 179 B13R1.713 CCC(NC(=O)C)c1ccncc1 WXVL_AK2375SB0150 [0,1,0,0,0,0|2,0,0]=3 180 B13R1.713 CC[C@H](NC(=O)C)c1ccccc1 WXVL_AK00525SB0150 [0,1,0,0,0,0|1,0,0]=2 181 B13R1.713 CC[C@H](NC(=O)C)c1ccccc1 WXVL_AK00525SB0150 [0,1,0,0,0,0|1,0,0]=2 182 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT0919 [0,0,0,1,0,0|2,0,1]=4 183 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT1115 [0,0,0,1,0,0|2,0,1]=4 184 B13R2.10 Cc1nnc(o1)c2ccccc2 WXVL_LR0506BT2957 [0,0,0,1,0,0|2,0,1]=4 185 B13R2.423 NC(=O)C1CC1c2ccccc2 WXVL_AK0084SB2474 [0,0,0,1,0,0|2,0,0]=3 186 B13R2.423 NC(=O)C1CC1c2ccccc2 WXVL_AK0084SB2474 [0,0,0,1,0,0|2,0,0]=3 187 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0084SB3176 [0,0,0,1,0,0|2,0,0]=3 188 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0084SB3176 [0,0,0,1,0,0|2,0,0]=3 189 B11R1.36 CC(C(=O)N)c1ccccc1 WXVL_AK0084SB2326 [0,0,0,0,1,0|1,0,0]=2 190 B11R1.36 CC(C(=O)N)c1ccccc1 WXVL_AK0084SB2326 [0,0,0,0,1,0|1,0,0]=2 191 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,0,0,0,1,0|2,0,1]=4 192 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,0,0,0,1,0|2,0,1]=4 193 B11R1.36 NC(=O)C(O)c1ccccc1 WXVL_AK0084SB0168 [0,0,0,0,1,0|2,0,0]=3 194 B11R1.36 NC(=O)C(O)c1ccccc1 WXVL_AK0084SB0168 [0,0,0,0,1,0|2,0,0]=3 195 B11R1.77 CC(=O)NC(C)c1ccno1 WXVL_AK6536SB0150 [0,0,0,0,1,0|3,0,0]=4 196 B11R1.77 CC(=O)NC(C)c1ccno1 WXVL_AK6536SB0150 [0,0,0,0,1,0|3,0,0]=4 197 B11R1.77 CC(=O)NC(C)c1ccsc1 WXVL_AK8258SB0150 [0,0,0,0,1,0|2,0,0]=3 198 B11R1.77 CC(=O)NC(C)c1ccsc1 WXVL_AK8258SB0150 [0,0,0,0,1,0|2,0,0]=3 199 B11R1.77 CC(=O)NC(C)c1nccs1 WXVL_AK2109SB0150 [0,0,0,0,1,0|3,0,0]=4 200 B11R1.77 CC(=O)NC(C)c1nccs1 WXVL_AK2109SB0150 [0,0,0,0,1,0|3,0,0]=4 201 B11R1.77 CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0150 [0,0,0,0,1,0|2,0,0]=3 202 B11R1.77 CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0150 [0,0,0,0,1,0|2,0,0]=3 203 B13R1.45 CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0150 [0,0,0,0,0,1|1,0,0]=2 204 B13R1.45 CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0150 [0,0,0,0,0,1|1,0,0]=2 205 B13R1.45 CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0150 [0,0,0,0,0,1|2,0,0]=3 206 B13R1.45 CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0150 [0,0,0,0,0,1|2,0,0]=3 207 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0150 [0,0,0,0,0,1|1,0,0]=2 208 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0150 [0,0,0,0,0,1|1,0,0]=2 209 B13R1.348 CC(CC(=O)N)Oc1ccccc1 WXVL_AK0084SA00047 [0,0,0,0,0,1|2,0,0]=3 210 B13R1.348 CC(CC(=O)N)Oc1ccccc1 WXVL_AK0084SA00047 [0,0,0,0,0,1|2,0,0]=3 211 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [1,1,0,0,0,0|2,0,0]=4 213 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [1,1,0,0,0,0|1,0,0]=3 214 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [1,1,0,0,0,0|1,0,0]=3 215 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [1,1,0,0,0,0|1,0,0]=3 216 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [1,1,0,0,0,0|1,0,0]=3 217 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [1,1,0,0,0,0|1,0,0]=3 218 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [1,1,0,0,0,0|1,0,0]=3 219 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [1,1,0,0,0,0|1,0,0]=3 220 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [1,1,0,0,0,0|1,0,0]=3 221 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [1,1,0,0,0,0|1,0,0]=3 222 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [1,1,0,0,0,0|1,0,0]=3 223 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [1,1,0,0,0,0|1,0,0]=3 224 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [1,1,0,0,0,0|1,0,0]=3 225 B12R1.21 CC(=O)NCc1ccc(cn1)Br WXVL_AK00267SB0150 [1,1,0,0,0,0|2,0,0]=4 226 B12R1.21 CC(=O)NCc1ccc(cn1)Br WXVL_AK00267SB0150 [1,1,0,0,0,0|2,0,0]=4 227 B12R1.21 CC(=O)NCc1ccc(cn1)C WXVL_AK0577SB0150 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.21 CC(=O)NCc1ccc(cn1)C WXVL_AK0577SB0150 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.21 CC(=O)NCc1ccc(cn1)Cl WXVL_AK2138SB0150 [1,1,0,0,0,0|2,0,0]=4 230 B12R1.21 CC(=O)NCc1ccc(cn1)Cl WXVL_AK2138SB0150 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.21 CC(=O)NCc1ccc(cn1)F WXVL_AK2932SB0150 [1,1,0,0,0,0|2,0,0]=4 232 B12R1.21 CC(=O)NCc1ccc(cn1)F WXVL_AK2932SB0150 [1,1,0,0,0,0|2,0,0]=4 233 B12R1.21 CC(=O)NCc1ccc(nc1)Br WXVL_AK0215SB0150 [1,1,0,0,0,0|2,0,0]=4 234 B12R1.21 CC(=O)NCc1ccc(nc1)Br WXVL_AK0215SB0150 [1,1,0,0,0,0|2,0,0]=4 235 B12R1.21 CC(=O)NCc1ccc(nc1)C WXVL_AK00257SB0150 [1,1,0,0,0,0|2,0,0]=4 236 B12R1.21 CC(=O)NCc1ccc(nc1)C WXVL_AK00257SB0150 [1,1,0,0,0,0|2,0,0]=4 237 B12R1.21 CC(=O)NCc1ccc(nc1)Cl WXVL_AK0135SB0150 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.21 CC(=O)NCc1ccc(nc1)Cl WXVL_AK0135SB0150 [1,1,0,0,0,0|2,0,0]=4 239 B12R1.21 CC(=O)NCc1ccc(nc1)F WXVL_AK4307SB0150 [1,1,0,0,0,0|2,0,0]=4 240 B12R1.21 CC(=O)NCc1ccc(nc1)F WXVL_AK4307SB0150 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.21 CC(=O)NCc1ccc(nc1)O WXVL_AK2049SB0150 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.21 CC(=O)NCc1ccc(nc1)O WXVL_AK2049SB0150 [1,1,0,0,0,0|2,0,0]=4 243 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [1,1,0,0,0,0|2,0,0]=4 245 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [1,1,0,0,0,0|2,0,0]=4 246 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [1,1,0,0,0,0|2,0,0]=4 248 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [1,1,0,0,0,0|2,0,0]=4 251 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [1,1,0,0,0,0|1,0,1]=4 252 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [1,1,0,0,0,0|1,0,0]=3 254 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [1,1,0,0,0,0|1,0,0]=3 255 B12R1.27 CCC(=O)NCc1ccccn1 WXVL_AK0018SB0064 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.27 CCC(=O)NCc1ccccn1 WXVL_AK0018SB0064 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [1,1,0,0,0,0|2,0,0]=4 258 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [1,1,0,0,0,0|2,0,0]=4 259 B12R1.27 CCC(=O)NCc1ccncc1 WXVL_AK0021SB0064 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.27 CCC(=O)NCc1ccncc1 WXVL_AK0021SB0064 [1,1,0,0,0,0|2,0,0]=4 261 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [1,1,0,0,0,0|1,0,1]=4 262 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [1,1,0,0,0,0|1,0,1]=4 263 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [1,1,0,0,0,0|1,0,1]=4 264 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [1,1,0,0,0,0|1,0,1]=4 265 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,1,0,0,0,0|1,0,0]=3 266 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,1,0,0,0,0|1,0,0]=3 267 B12R1.27 CNC(=O)CCc1ccccn1 WXVL_AK00442SA0316 [1,1,0,0,0,0|2,0,0]=4 268 B12R1.27 CNC(=O)CCc1ccccn1 WXVL_AK00442SA0316 [1,1,0,0,0,0|2,0,0]=4 269 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [1,1,0,0,0,0|2,0,0]=4 270 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [1,1,0,0,0,0|2,0,0]=4 271 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [1,1,0,0,0,0|2,0,0]=4 274 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [1,1,0,0,0,0|1,0,0]=3 276 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [1,1,0,0,0,0|1,0,0]=3 277 B12R1.27 O=C(CO)NCc1ccccn1 WXVL_AK0018SB2706 [1,1,0,0,0,0|2,0,0]=4 278 B12R1.27 O=C(CO)NCc1ccccn1 WXVL_AK0018SB2706 [1,1,0,0,0,0|2,0,0]=4 279 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [1,1,0,0,0,0|2,0,0]=4 281 B12R1.27 O=C(CO)NCc1ccncc1 WXVL_AK0021SB2706 [1,1,0,0,0,0|2,0,0]=4 282 B12R1.27 O=C(CO)NCc1ccncc1 WXVL_AK0021SB2706 [1,1,0,0,0,0|2,0,0]=4 283 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [1,1,0,0,0,0|2,0,0]=4 286 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [1,1,0,0,0,0|2,0,0]=4 287 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [1,1,0,0,0,0|1,0,0]=3 288 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [1,1,0,0,0,0|1,0,0]=3 289 B12R1.43 CC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0150 [1,1,0,0,0,0|2,0,0]=4 290 B12R1.43 CC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0150 [1,1,0,0,0,0|2,0,0]=4 291 B12R1.43 CC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0150 [1,1,0,0,0,0|2,0,0]=4 292 B12R1.43 CC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0150 [1,1,0,0,0,0|2,0,0]=4 293 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [1,1,0,0,0,0|2,0,0]=4 294 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [1,1,0,0,0,0|2,0,0]=4 295 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [1,1,0,0,0,0|1,0,0]=3 296 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [1,1,0,0,0,0|1,0,0]=3 297 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [1,1,0,0,0,0|1,0,0]=3 298 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [1,1,0,0,0,0|1,0,0]=3 299 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [1,1,0,0,0,0|1,0,0]=3 300 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [1,1,0,0,0,0|1,0,0]=3 301 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [1,1,0,0,0,0|1,0,0]=3 302 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [1,1,0,0,0,0|1,0,0]=3 303 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [1,1,0,0,0,0|1,0,0]=3 304 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [1,1,0,0,0,0|1,0,0]=3 305 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [1,1,0,0,0,0|1,0,0]=3 306 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [1,1,0,0,0,0|1,0,0]=3 307 B12R1.125 CC(=O)NCc1cccnc1Br WXVL_AK4357SB0150 [1,1,0,0,0,0|2,0,0]=4 308 B12R1.125 CC(=O)NCc1cccnc1Br WXVL_AK4357SB0150 [1,1,0,0,0,0|2,0,0]=4 309 B12R1.125 CC(=O)NCc1cccnc1C WXVL_AK00258SB0150 [1,1,0,0,0,0|2,0,0]=4 310 B12R1.125 CC(=O)NCc1cccnc1C WXVL_AK00258SB0150 [1,1,0,0,0,0|2,0,0]=4 311 B12R1.125 CC(=O)NCc1cccnc1F WXVL_AK00552SB0150 [1,1,0,0,0,0|2,0,0]=4 312 B12R1.125 CC(=O)NCc1cccnc1F WXVL_AK00552SB0150 [1,1,0,0,0,0|2,0,0]=4 313 B12R1.125 CC(=O)NCc1ccncc1Cl WXVL_AK3976SB0150 [1,1,0,0,0,0|2,0,0]=4 314 B12R1.125 CC(=O)NCc1ccncc1Cl WXVL_AK3976SB0150 [1,1,0,0,0,0|2,0,0]=4 315 B12R1.125 CC(=O)NCc1ccncc1F WXVL_AK1489SB0150 [1,1,0,0,0,0|2,0,0]=4 316 B12R1.125 CC(=O)NCc1ccncc1F WXVL_AK1489SB0150 [1,1,0,0,0,0|2,0,0]=4 317 B12R1.125 CC(=O)NCc1cnccc1C WXVL_AK1230SB0150 [1,1,0,0,0,0|2,0,0]=4 318 B12R1.125 CC(=O)NCc1cnccc1C WXVL_AK1230SB0150 [1,1,0,0,0,0|2,0,0]=4 319 B12R1.125 CC(=O)NCc1cnccc1Cl WXVL_AK0322SB0150 [1,1,0,0,0,0|2,0,0]=4 320 B12R1.125 CC(=O)NCc1cnccc1Cl WXVL_AK0322SB0150 [1,1,0,0,0,0|2,0,0]=4 321 B12R1.125 CC(=O)NCc1ncccc1C WXVL_AK0162SB0150 [1,1,0,0,0,0|2,0,0]=4 322 B12R1.125 CC(=O)NCc1ncccc1C WXVL_AK0162SB0150 [1,1,0,0,0,0|2,0,0]=4 323 B12R1.125 CC(=O)NCc1ncccc1F WXVL_AK00098SB0150 [1,1,0,0,0,0|2,0,0]=4 324 B12R1.125 CC(=O)NCc1ncccc1F WXVL_AK00098SB0150 [1,1,0,0,0,0|2,0,0]=4 325 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [1,1,0,0,0,0|2,0,0]=4 326 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [1,1,0,0,0,0|2,0,0]=4 327 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [1,1,0,0,0,0|2,0,0]=4 328 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [1,1,0,0,0,0|2,0,0]=4 329 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [1,1,0,0,0,0|2,0,0]=4 330 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [1,1,0,0,0,0|2,0,0]=4 331 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [1,1,0,0,0,0|2,0,0]=4 332 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [1,1,0,0,0,0|2,0,0]=4 333 B12R1.226 CC(=O)NCc1cc(ccn1)Br WXVL_AK1470SB0150 [1,1,0,0,0,0|2,0,0]=4 334 B12R1.226 CC(=O)NCc1cc(ccn1)Br WXVL_AK1470SB0150 [1,1,0,0,0,0|2,0,0]=4 335 B12R1.226 CC(=O)NCc1cc(ccn1)C WXVL_AK00280SB0150 [1,1,0,0,0,0|2,0,0]=4 336 B12R1.226 CC(=O)NCc1cc(ccn1)C WXVL_AK00280SB0150 [1,1,0,0,0,0|2,0,0]=4 337 B12R1.226 CC(=O)NCc1cc(ccn1)Cl WXVL_AK0280SB0150 [1,1,0,0,0,0|2,0,0]=4 338 B12R1.226 CC(=O)NCc1cc(ccn1)Cl WXVL_AK0280SB0150 [1,1,0,0,0,0|2,0,0]=4 339 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [1,1,0,0,0,0|1,0,0]=3 340 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [1,1,0,0,0,0|1,0,0]=3 341 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [1,1,0,0,0,0|1,0,0]=3 342 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [1,1,0,0,0,0|1,0,0]=3 343 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [1,1,0,0,0,0|1,0,0]=3 344 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [1,1,0,0,0,0|1,0,0]=3 345 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [1,1,0,0,0,0|1,0,0]=3 346 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [1,1,0,0,0,0|1,0,0]=3 347 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [1,1,0,0,0,0|1,0,0]=3 348 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [1,1,0,0,0,0|1,0,0]=3 349 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [1,1,0,0,0,0|1,0,0]=3 350 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [1,1,0,0,0,0|1,0,0]=3 351 B12R1.226 CC(=O)NCc1cccc(n1)Br WXVL_AK2161SB0150 [1,1,0,0,0,0|2,0,0]=4 352 B12R1.226 CC(=O)NCc1cccc(n1)Br WXVL_AK2161SB0150 [1,1,0,0,0,0|2,0,0]=4 353 B12R1.226 CC(=O)NCc1cccc(n1)C WXVL_AK0164SB0150 [1,1,0,0,0,0|2,0,0]=4 354 B12R1.226 CC(=O)NCc1cccc(n1)C WXVL_AK0164SB0150 [1,1,0,0,0,0|2,0,0]=4 355 B12R1.226 CC(=O)NCc1cccc(n1)F WXVL_AK1928SB0150 [1,1,0,0,0,0|2,0,0]=4 356 B12R1.226 CC(=O)NCc1cccc(n1)F WXVL_AK1928SB0150 [1,1,0,0,0,0|2,0,0]=4 357 B12R1.226 CC(=O)NCc1ccnc(c1)Br WXVL_AK2247SB0150 [1,1,0,0,0,0|2,0,0]=4 358 B12R1.226 CC(=O)NCc1ccnc(c1)Br WXVL_AK2247SB0150 [1,1,0,0,0,0|2,0,0]=4 359 B12R1.226 CC(=O)NCc1ccnc(c1)C WXVL_AK0517SB0150 [1,1,0,0,0,0|2,0,0]=4 360 B12R1.226 CC(=O)NCc1ccnc(c1)C WXVL_AK0517SB0150 [1,1,0,0,0,0|2,0,0]=4 361 B12R1.226 CC(=O)NCc1ccnc(c1)Cl WXVL_AK0323SB0150 [1,1,0,0,0,0|2,0,0]=4 362 B12R1.226 CC(=O)NCc1ccnc(c1)Cl WXVL_AK0323SB0150 [1,1,0,0,0,0|2,0,0]=4 363 B12R1.226 CC(=O)NCc1ccnc(c1)F WXVL_AK00762SB0150 [1,1,0,0,0,0|2,0,0]=4 364 B12R1.226 CC(=O)NCc1ccnc(c1)F WXVL_AK00762SB0150 [1,1,0,0,0,0|2,0,0]=4 365 B12R1.226 CC(=O)NCc1cncc(c1)Br WXVL_AK2589SB0150 [1,1,0,0,0,0|2,0,0]=4 366 B12R1.226 CC(=O)NCc1cncc(c1)Br WXVL_AK2589SB0150 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.226 CC(=O)NCc1cncc(c1)C WXVL_AK00253SB0150 [1,1,0,0,0,0|2,0,0]=4 368 B12R1.226 CC(=O)NCc1cncc(c1)C WXVL_AK00253SB0150 [1,1,0,0,0,0|2,0,0]=4 369 B12R1.226 CC(=O)NCc1cncc(c1)Cl WXVL_AK3939SB0150 [1,1,0,0,0,0|2,0,0]=4 370 B12R1.226 CC(=O)NCc1cncc(c1)Cl WXVL_AK3939SB0150 [1,1,0,0,0,0|2,0,0]=4 371 B12R1.226 CC(=O)NCc1cncc(c1)F WXVL_AK1430SB0150 [1,1,0,0,0,0|2,0,0]=4 372 B12R1.226 CC(=O)NCc1cncc(c1)F WXVL_AK1430SB0150 [1,1,0,0,0,0|2,0,0]=4 373 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [1,1,0,0,0,0|2,0,0]=4 374 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [1,1,0,0,0,0|2,0,0]=4 375 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [1,1,0,0,0,0|2,0,0]=4 376 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [1,1,0,0,0,0|2,0,0]=4 377 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [1,1,0,0,0,0|2,0,0]=4 379 B12R1.20 CC(C(=O)N)c1ccc(cc1)Cl WXVL_AK0084SB0484 [0,1,0,0,1,0|1,0,0]=3 380 B12R1.20 CC(C(=O)N)c1ccc(cc1)Cl WXVL_AK0084SB0484 [0,1,0,0,1,0|1,0,0]=3 381 B12R1.20 CC(C(=O)N)c1ccc(cc1)O WXVL_AK0084SB5200 [0,1,0,0,1,0|1,0,0]=3 382 B12R1.20 CC(C(=O)N)c1ccc(cc1)O WXVL_AK0084SB5200 [0,1,0,0,1,0|1,0,0]=3 383 B12R1.20 Cc1ccc(cc1)C(C)C(=O)N WXVL_AK0084SB0423 [0,1,0,0,1,0|1,0,0]=3 384 B12R1.20 Cc1ccc(cc1)C(C)C(=O)N WXVL_AK0084SB0423 [0,1,0,0,1,0|1,0,0]=3 385 B12R1.124 CC(=O)N(C)c1ncccc1N WXVL_AF0164SB0150 [0,1,0,0,1,0|2,0,0]=4 386 B12R1.124 CC(=O)N(C)c1ncccc1N WXVL_AF0164SB0150 [0,1,0,0,1,0|2,0,0]=4 387 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl WXVL_AK0084SB3309 [0,1,0,0,1,0|2,0,0]=4 388 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl WXVL_AK0084SB3309 [0,1,0,0,1,0|2,0,0]=4 389 B12R1.225 CC(=O)N(C)c1cccc(c1)N WXVL_AG3393SB0150 [0,1,0,0,1,0|1,0,0]=3 390 B12R1.225 CC(=O)N(C)c1cccc(c1)N WXVL_AG3393SB0150 [0,1,0,0,1,0|1,0,0]=3 391 B12R1.225 NC(=O)C(O)c1cccc(c1)Br WXVL_AK0084SA00095 [0,1,0,0,1,0|2,0,0]=4 392 B12R1.225 NC(=O)C(O)c1cccc(c1)Br WXVL_AK0084SA00095 [0,1,0,0,1,0|2,0,0]=4 393 B12R1.253 CC(C)(C(=O)N)c1ccccc1 WXVL_AK0084SB0135 [0,1,0,0,1,0|1,0,0]=3 394 B12R1.253 CC(C)(C(=O)N)c1ccccc1 WXVL_AK0084SB0135 [0,1,0,0,1,0|1,0,0]=3 395 B12R1.253 NC(=O)C(F)(F)c1ccccc1 WXVL_AK0084SB1457 [0,1,0,0,1,0|2,0,0]=4 396 B12R1.253 NC(=O)C(F)(F)c1ccccc1 WXVL_AK0084SB1457 [0,1,0,0,1,0|2,0,0]=4 397 B12R1.478 CCC(C(=O)N)c1ccccc1 WXVL_AK0084SB0053 [0,1,0,0,1,0|1,0,0]=3 398 B12R1.478 CCC(C(=O)N)c1ccccc1 WXVL_AK0084SB0053 [0,1,0,0,1,0|1,0,0]=3 399 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,1,0,0,1,0|1,0,0]=3 400 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,1,0,0,1,0|1,0,0]=3 401 B12R1.478 NC(=O)C(CO)c1ccccc1 WXVL_AK0084SB3228 [0,1,0,0,1,0|1,0,0]=3 402 B12R1.478 NC(=O)C(CO)c1ccccc1 WXVL_AK0084SB3228 [0,1,0,0,1,0|1,0,0]=3 403 B12R1.15 CC(NC(=O)CO)c1ccsc1 WXVL_AK8258SB2706 [0,1,0,0,1,0|2,0,0]=4 404 B12R1.15 CC(NC(=O)CO)c1ccsc1 WXVL_AK8258SB2706 [0,1,0,0,1,0|2,0,0]=4 405 B12R1.15 CCC(=O)NC(C)c1ccsc1 WXVL_AK8258SB0064 [0,1,0,0,1,0|2,0,0]=4 406 B12R1.15 CCC(=O)NC(C)c1ccsc1 WXVL_AK8258SB0064 [0,1,0,0,1,0|2,0,0]=4 407 B12R1.15 CCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0064 [0,1,0,0,1,0|2,0,0]=4 408 B12R1.15 CCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0064 [0,1,0,0,1,0|2,0,0]=4 409 B12R1.15 C[C@H](NC(=O)CO)c1cccs1 WXVL_AK00667SB2706 [0,1,0,0,1,0|2,0,0]=4 410 B12R1.15 C[C@H](NC(=O)CO)c1cccs1 WXVL_AK00667SB2706 [0,1,0,0,1,0|2,0,0]=4 411 B12R1.103 CC(=O)NC(C)c1ccc(s1)Br WXVL_AK1054SB0150 [0,1,0,0,1,0|2,0,0]=4 412 B12R1.103 CC(=O)NC(C)c1ccc(s1)Br WXVL_AK1054SB0150 [0,1,0,0,1,0|2,0,0]=4 413 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB0150 [0,1,0,0,0,1|2,0,0]=4 414 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB0150 [0,1,0,0,0,1|2,0,0]=4 415 B14R1.163 C#CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0338 [0,1,0,0,0,1|1,0,1]=4 416 B14R1.163 C#CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0338 [0,1,0,0,0,1|1,0,1]=4 417 B14R1.163 C#CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0338 [0,1,0,0,0,1|1,0,1]=4 418 B14R1.163 C#CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0338 [0,1,0,0,0,1|1,0,1]=4 419 B14R1.163 CC(CNC(=O)CO)c1ccccc1 WXVL_AK00546SB2706 [0,1,0,0,0,1|1,0,0]=3 420 B14R1.163 CC(CNC(=O)CO)c1ccccc1 WXVL_AK00546SB2706 [0,1,0,0,0,1|1,0,0]=3 421 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [0,1,0,0,0,1|1,0,0]=3 422 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [0,1,0,0,0,1|1,0,0]=3 423 B14R1.163 CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0064 [0,1,0,0,0,1|2,0,0]=4 424 B14R1.163 CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0064 [0,1,0,0,0,1|2,0,0]=4 425 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [0,1,0,0,0,1|1,0,0]=3 426 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [0,1,0,0,0,1|1,0,0]=3 427 B14R1.163 C[C@H](CNC(=O)CO)c1ccccc1 WXVL_AK00506SB2706 [0,1,0,0,0,1|1,0,0]=3 428 B14R1.163 C[C@H](CNC(=O)CO)c1ccccc1 WXVL_AK00506SB2706 [0,1,0,0,0,1|1,0,0]=3 429 B14R1.163 O=C(CO)NCC(O)c1ccccc1 WXVL_AK0051SB2706 [0,1,0,0,0,1|2,0,0]=4 430 B14R1.163 O=C(CO)NCC(O)c1ccccc1 WXVL_AK0051SB2706 [0,1,0,0,0,1|2,0,0]=4 431 B14R1.415 CC(=O)C(=O)NC(C)c1ccccn1 WXVL_AK0585SB0051 [0,1,0,0,0,1|2,0,0]=4 432 B14R1.415 CC(=O)C(=O)NC(C)c1ccccn1 WXVL_AK0585SB0051 [0,1,0,0,0,1|2,0,0]=4 433 B14R1.415 CC(=O)C(=O)NC(C)c1ccncc1 WXVL_AK0282SB0051 [0,1,0,0,0,1|2,0,0]=4 434 B14R1.415 CC(=O)C(=O)NC(C)c1ccncc1 WXVL_AK0282SB0051 [0,1,0,0,0,1|2,0,0]=4 435 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0051 [0,1,0,0,0,1|2,0,0]=4 436 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0051 [0,1,0,0,0,1|2,0,0]=4 437 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0051 [0,1,0,0,0,1|2,0,0]=4 438 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0051 [0,1,0,0,0,1|2,0,0]=4 439 B14R1.415 CC(=O)C(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0051 [0,1,0,0,0,1|2,0,0]=4 440 B14R1.415 CC(=O)C(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0051 [0,1,0,0,0,1|2,0,0]=4 441 B14R1.415 CC(=O)C(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0051 [0,1,0,0,0,1|2,0,0]=4 442 B14R1.415 CC(=O)C(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0051 [0,1,0,0,0,1|2,0,0]=4 443 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 WXVL_AN3044SB0150 [0,1,0,0,0,1|2,0,0]=4 444 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 WXVL_AN3044SB0150 [0,1,0,0,0,1|2,0,0]=4 445 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB0150 [0,1,0,0,0,1|2,0,0]=4 446 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB0150 [0,1,0,0,0,1|2,0,0]=4 447 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 WXVL_AK0159SB0150 [0,1,0,0,0,1|1,0,0]=3 448 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 WXVL_AK0159SB0150 [0,1,0,0,0,1|1,0,0]=3 449 B14R1.425 CC(=O)C(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0051 [0,1,0,0,0,1|2,0,0]=4 450 B14R1.425 CC(=O)C(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0051 [0,1,0,0,0,1|2,0,0]=4 451 B14R1.549 CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0150 [0,1,0,0,0,1|1,0,0]=3 452 B14R1.549 CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0150 [0,1,0,0,0,1|1,0,0]=3 453 B14R1.743 CNC(=O)CC(C)Oc1ccccc1 WXVL_AK00442SA00047 [0,1,0,0,0,1|1,0,0]=3 454 B14R1.743 CNC(=O)CC(C)Oc1ccccc1 WXVL_AK00442SA00047 [0,1,0,0,0,1|1,0,0]=3 455 B14R1.5978 CC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0150 [0,1,0,0,0,1|1,0,0]=3 456 B14R1.5978 CC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0150 [0,1,0,0,0,1|1,0,0]=3 457 B14R1.10 C#CC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0338 [0,2,0,0,0,0|1,0,1]=4 458 B14R1.10 C#CC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0338 [0,2,0,0,0,0|1,0,1]=4 459 B14R1.10 C#CC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0338 [0,2,0,0,0,0|1,0,1]=4 460 B14R1.10 C#CC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0338 [0,2,0,0,0,0|1,0,1]=4 461 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0338 [0,2,0,0,0,0|1,0,1]=4 462 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0338 [0,2,0,0,0,0|1,0,1]=4 463 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0338 [0,2,0,0,0,0|1,0,1]=4 464 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0338 [0,2,0,0,0,0|1,0,1]=4 465 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0338 [0,2,0,0,0,0|1,0,1]=4 466 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0338 [0,2,0,0,0,0|1,0,1]=4 467 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0338 [0,2,0,0,0,0|1,0,1]=4 468 B14R1.10 C#CC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0338 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0338 [0,2,0,0,0,0|1,0,1]=4 470 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0338 [0,2,0,0,0,0|1,0,1]=4 471 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0338 [0,2,0,0,0,0|1,0,1]=4 472 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0338 [0,2,0,0,0,0|1,0,1]=4 473 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0338 [0,2,0,0,0,0|1,0,1]=4 474 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0338 [0,2,0,0,0,0|1,0,1]=4 475 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0338 [0,2,0,0,0,0|1,0,1]=4 476 B14R1.10 C#CC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0338 [0,2,0,0,0,0|1,0,1]=4 477 B14R1.10 CC(NC(=O)CO)c1ccc(cc1)Cl WXVL_AK0781SB2706 [0,2,0,0,0,0|1,0,0]=3 478 B14R1.10 CC(NC(=O)CO)c1ccc(cc1)Cl WXVL_AK0781SB2706 [0,2,0,0,0,0|1,0,0]=3 479 B14R1.10 CC(NC(=O)CO)c1ccc(cc1)I WXVL_AK1696SB2706 [0,2,0,0,0,0|1,0,0]=3 480 B14R1.10 CC(NC(=O)CO)c1ccc(cc1)I WXVL_AK1696SB2706 [0,2,0,0,0,0|1,0,0]=3 481 B14R1.10 CC(NC(=O)CO)c1ccc(cn1)Br WXVL_AK3272SB2706 [0,2,0,0,0,0|2,0,0]=4 482 B14R1.10 CC(NC(=O)CO)c1ccc(cn1)Br WXVL_AK3272SB2706 [0,2,0,0,0,0|2,0,0]=4 483 B14R1.10 CCC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0064 [0,2,0,0,0,0|1,0,0]=3 484 B14R1.10 CCC(=O)NC(C)c1ccc(cc1)Cl WXVL_AK0781SB0064 [0,2,0,0,0,0|1,0,0]=3 485 B14R1.10 CCC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0064 [0,2,0,0,0,0|1,0,0]=3 486 B14R1.10 CCC(=O)NC(C)c1ccc(cc1)I WXVL_AK1696SB0064 [0,2,0,0,0,0|1,0,0]=3 487 B14R1.10 CCC(=O)NC(C)c1ccc(cn1)Br WXVL_AK3272SB0064 [0,2,0,0,0,0|2,0,0]=4 488 B14R1.10 CCC(=O)NC(C)c1ccc(cn1)Br WXVL_AK3272SB0064 [0,2,0,0,0,0|2,0,0]=4 489 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0064 [0,2,0,0,0,0|1,0,0]=3 490 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)Br WXVL_AK00779SB0064 [0,2,0,0,0,0|1,0,0]=3 491 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0064 [0,2,0,0,0,0|1,0,0]=3 492 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)C WXVL_AK00482SB0064 [0,2,0,0,0,0|1,0,0]=3 493 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0064 [0,2,0,0,0,0|1,0,0]=3 494 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)Cl WXVL_AK00400SB0064 [0,2,0,0,0,0|1,0,0]=3 495 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0064 [0,2,0,0,0,0|1,0,0]=3 496 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cc1)F WXVL_AK0154SB0064 [0,2,0,0,0,0|1,0,0]=3 497 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cn1)Br WXVL_AK00364SB0064 [0,2,0,0,0,0|2,0,0]=4 498 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(cn1)Br WXVL_AK00364SB0064 [0,2,0,0,0,0|2,0,0]=4 499 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0064 [0,2,0,0,0,0|1,0,0]=3 500 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)Br WXVL_AK1560SB0064 [0,2,0,0,0,0|1,0,0]=3 501 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0064 [0,2,0,0,0,0|1,0,0]=3 502 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)Cl WXVL_AK00479SB0064 [0,2,0,0,0,0|1,0,0]=3 503 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0064 [0,2,0,0,0,0|1,0,0]=3 504 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)F WXVL_AK00709SB0064 [0,2,0,0,0,0|1,0,0]=3 505 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0064 [0,2,0,0,0,0|1,0,0]=3 506 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cc1)O WXVL_AK00814SB0064 [0,2,0,0,0,0|1,0,0]=3 507 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cn1)Br WXVL_AK00397SB0064 [0,2,0,0,0,0|2,0,0]=4 508 B14R1.10 CCC(=O)N[C@H](C)c1ccc(cn1)Br WXVL_AK00397SB0064 [0,2,0,0,0,0|2,0,0]=4 509 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Br WXVL_AK1560SB2706 [0,2,0,0,0,0|1,0,0]=3 510 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Br WXVL_AK1560SB2706 [0,2,0,0,0,0|1,0,0]=3 511 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Cl WXVL_AK00479SB2706 [0,2,0,0,0,0|1,0,0]=3 512 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Cl WXVL_AK00479SB2706 [0,2,0,0,0,0|1,0,0]=3 513 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)F WXVL_AK00709SB2706 [0,2,0,0,0,0|1,0,0]=3 514 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)F WXVL_AK00709SB2706 [0,2,0,0,0,0|1,0,0]=3 515 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)O WXVL_AK00814SB2706 [0,2,0,0,0,0|1,0,0]=3 516 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)O WXVL_AK00814SB2706 [0,2,0,0,0,0|1,0,0]=3 517 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cn1)Br WXVL_AK00397SB2706 [0,2,0,0,0,0|2,0,0]=4 518 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cn1)Br WXVL_AK00397SB2706 [0,2,0,0,0,0|2,0,0]=4 519 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)Br WXVL_AK00779SB2706 [0,2,0,0,0,0|1,0,0]=3 520 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)Br WXVL_AK00779SB2706 [0,2,0,0,0,0|1,0,0]=3 521 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)Cl WXVL_AK00400SB2706 [0,2,0,0,0,0|1,0,0]=3 522 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)Cl WXVL_AK00400SB2706 [0,2,0,0,0,0|1,0,0]=3 523 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)F WXVL_AK0154SB2706 [0,2,0,0,0,0|1,0,0]=3 524 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cc1)F WXVL_AK0154SB2706 [0,2,0,0,0,0|1,0,0]=3 525 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cn1)Br WXVL_AK00364SB2706 [0,2,0,0,0,0|2,0,0]=4 526 B14R1.10 C[C@H](NC(=O)CO)c1ccc(cn1)Br WXVL_AK00364SB2706 [0,2,0,0,0,0|2,0,0]=4 527 B14R1.10 Cc1ccc(cc1)[C@H](C)NC(=O)CO WXVL_AK00482SB2706 [0,2,0,0,0,0|1,0,0]=3 528 B14R1.10 Cc1ccc(cc1)[C@H](C)NC(=O)CO WXVL_AK00482SB2706 [0,2,0,0,0,0|1,0,0]=3 529 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0338 [0,2,0,0,0,0|1,0,1]=4 530 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0338 [0,2,0,0,0,0|1,0,1]=4 531 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0338 [0,2,0,0,0,0|1,0,1]=4 532 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0338 [0,2,0,0,0,0|1,0,1]=4 533 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0338 [0,2,0,0,0,0|1,0,1]=4 534 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0338 [0,2,0,0,0,0|1,0,1]=4 535 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0338 [0,2,0,0,0,0|1,0,1]=4 536 B14R1.11 C#CC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0338 [0,2,0,0,0,0|1,0,1]=4 537 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0338 [0,2,0,0,0,0|1,0,1]=4 538 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0338 [0,2,0,0,0,0|1,0,1]=4 539 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0338 [0,2,0,0,0,0|1,0,1]=4 540 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0338 [0,2,0,0,0,0|1,0,1]=4 541 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0338 [0,2,0,0,0,0|1,0,1]=4 542 B14R1.11 C#CC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0338 [0,2,0,0,0,0|1,0,1]=4 543 B14R1.11 CC(NC(=O)CO)c1cccc(c1)Br WXVL_AK00193SB2706 [0,2,0,0,0,0|1,0,0]=3 544 B14R1.11 CC(NC(=O)CO)c1cccc(c1)Br WXVL_AK00193SB2706 [0,2,0,0,0,0|1,0,0]=3 545 B14R1.11 CC(NC(=O)CO)c1cccc(c1)Cl WXVL_AK00396SB2706 [0,2,0,0,0,0|1,0,0]=3 546 B14R1.11 CC(NC(=O)CO)c1cccc(c1)Cl WXVL_AK00396SB2706 [0,2,0,0,0,0|1,0,0]=3 547 B14R1.11 CC(NC(=O)CO)c1cccc(c1)F WXVL_AK00404SB2706 [0,2,0,0,0,0|1,0,0]=3 548 B14R1.11 CC(NC(=O)CO)c1cccc(c1)F WXVL_AK00404SB2706 [0,2,0,0,0,0|1,0,0]=3 549 B14R1.11 CCC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0064 [0,2,0,0,0,0|1,0,0]=3 550 B14R1.11 CCC(=O)NC(C)c1cccc(c1)Br WXVL_AK00193SB0064 [0,2,0,0,0,0|1,0,0]=3 551 B14R1.11 CCC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0064 [0,2,0,0,0,0|1,0,0]=3 552 B14R1.11 CCC(=O)NC(C)c1cccc(c1)C WXVL_AK2892SB0064 [0,2,0,0,0,0|1,0,0]=3 553 B14R1.11 CCC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0064 [0,2,0,0,0,0|1,0,0]=3 554 B14R1.11 CCC(=O)NC(C)c1cccc(c1)Cl WXVL_AK00396SB0064 [0,2,0,0,0,0|1,0,0]=3 555 B14R1.11 CCC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0064 [0,2,0,0,0,0|1,0,0]=3 556 B14R1.11 CCC(=O)NC(C)c1cccc(c1)F WXVL_AK00404SB0064 [0,2,0,0,0,0|1,0,0]=3 557 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0064 [0,2,0,0,0,0|1,0,0]=3 558 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)Br WXVL_AK2361SB0064 [0,2,0,0,0,0|1,0,0]=3 559 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0064 [0,2,0,0,0,0|1,0,0]=3 560 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)Cl WXVL_AK00346SB0064 [0,2,0,0,0,0|1,0,0]=3 561 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0064 [0,2,0,0,0,0|1,0,0]=3 562 B14R1.11 CCC(=O)N[C@H](C)c1cccc(c1)F WXVL_AK1917SB0064 [0,2,0,0,0,0|1,0,0]=3 563 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)Br WXVL_AK2361SB2706 [0,2,0,0,0,0|1,0,0]=3 564 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)Br WXVL_AK2361SB2706 [0,2,0,0,0,0|1,0,0]=3 565 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)Cl WXVL_AK00346SB2706 [0,2,0,0,0,0|1,0,0]=3 566 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)Cl WXVL_AK00346SB2706 [0,2,0,0,0,0|1,0,0]=3 567 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)F WXVL_AK1917SB2706 [0,2,0,0,0,0|1,0,0]=3 568 B14R1.11 C[C@@H](NC(=O)CO)c1cccc(c1)F WXVL_AK1917SB2706 [0,2,0,0,0,0|1,0,0]=3 569 B14R1.11 Cc1cccc(c1)C(C)NC(=O)CO WXVL_AK2892SB2706 [0,2,0,0,0,0|1,0,0]=3 570 B14R1.11 Cc1cccc(c1)C(C)NC(=O)CO WXVL_AK2892SB2706 [0,2,0,0,0,0|1,0,0]=3 571 B14R1.29 C#CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB3070 [0,2,0,0,0,0|2,0,0]=4 572 B14R1.29 C#CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB3070 [0,2,0,0,0,0|2,0,0]=4 573 B14R1.29 C#CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB3070 [0,2,0,0,0,0|2,0,0]=4 574 B14R1.29 C#CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB3070 [0,2,0,0,0,0|2,0,0]=4 575 B14R1.29 C#CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB3070 [0,2,0,0,0,0|2,0,0]=4 576 B14R1.29 C#CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB3070 [0,2,0,0,0,0|2,0,0]=4 577 B14R1.29 C#CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB3070 [0,2,0,0,0,0|2,0,0]=4 578 B14R1.29 C#CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB3070 [0,2,0,0,0,0|2,0,0]=4 579 B14R1.29 C#CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB3070 [0,2,0,0,0,0|2,0,0]=4 580 B14R1.29 C#CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB3070 [0,2,0,0,0,0|2,0,0]=4 581 B14R1.29 C#CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB3070 [0,2,0,0,0,0|2,0,0]=4 582 B14R1.29 C#CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB3070 [0,2,0,0,0,0|2,0,0]=4 583 B14R1.29 C/C=C/C(=O)NC(C)c1ccccn1 WXVL_AK0585SB0340 [0,2,0,0,0,0|2,0,0]=4 584 B14R1.29 C/C=C/C(=O)NC(C)c1ccccn1 WXVL_AK0585SB0340 [0,2,0,0,0,0|2,0,0]=4 585 B14R1.29 C/C=C/C(=O)NC(C)c1ccncc1 WXVL_AK0282SB0340 [0,2,0,0,0,0|2,0,0]=4 586 B14R1.29 C/C=C/C(=O)NC(C)c1ccncc1 WXVL_AK0282SB0340 [0,2,0,0,0,0|2,0,0]=4 587 B14R1.29 C/C=C/C(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0340 [0,2,0,0,0,0|2,0,0]=4 588 B14R1.29 C/C=C/C(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0340 [0,2,0,0,0,0|2,0,0]=4 589 B14R1.29 C/C=C/C(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0340 [0,2,0,0,0,0|2,0,0]=4 590 B14R1.29 C/C=C/C(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0340 [0,2,0,0,0,0|2,0,0]=4 591 B14R1.29 C/C=C/C(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0340 [0,2,0,0,0,0|2,0,0]=4 592 B14R1.29 C/C=C/C(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0340 [0,2,0,0,0,0|2,0,0]=4 593 B14R1.29 C/C=C/C(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0340 [0,2,0,0,0,0|2,0,0]=4 594 B14R1.29 C/C=C/C(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0340 [0,2,0,0,0,0|2,0,0]=4 595 B14R1.29 C=CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB2732 [0,2,0,0,0,0|2,0,0]=4 596 B14R1.29 C=CCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB2732 [0,2,0,0,0,0|2,0,0]=4 597 B14R1.29 C=CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB2732 [0,2,0,0,0,0|2,0,0]=4 598 B14R1.29 C=CCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB2732 [0,2,0,0,0,0|2,0,0]=4 599 B14R1.29 C=CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB2732 [0,2,0,0,0,0|2,0,0]=4 600 B14R1.29 C=CCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB2732 [0,2,0,0,0,0|2,0,0]=4 601 B14R1.29 C=CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB2732 [0,2,0,0,0,0|2,0,0]=4 602 B14R1.29 C=CCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB2732 [0,2,0,0,0,0|2,0,0]=4 603 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB2732 [0,2,0,0,0,0|2,0,0]=4 604 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB2732 [0,2,0,0,0,0|2,0,0]=4 605 B14R1.29 C=CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB2732 [0,2,0,0,0,0|2,0,0]=4 606 B14R1.29 C=CCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB2732 [0,2,0,0,0,0|2,0,0]=4 607 B14R1.29 CC#CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB1240 [0,2,0,0,0,0|2,0,0]=4 608 B14R1.29 CC#CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB1240 [0,2,0,0,0,0|2,0,0]=4 609 B14R1.29 CC#CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB1240 [0,2,0,0,0,0|2,0,0]=4 610 B14R1.29 CC#CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB1240 [0,2,0,0,0,0|2,0,0]=4 611 B14R1.29 CC#CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB1240 [0,2,0,0,0,0|2,0,0]=4 612 B14R1.29 CC#CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB1240 [0,2,0,0,0,0|2,0,0]=4 613 B14R1.29 CC#CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB1240 [0,2,0,0,0,0|2,0,0]=4 614 B14R1.29 CC#CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB1240 [0,2,0,0,0,0|2,0,0]=4 615 B14R1.29 CC#CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB1240 [0,2,0,0,0,0|2,0,0]=4 616 B14R1.29 CC#CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB1240 [0,2,0,0,0,0|2,0,0]=4 617 B14R1.29 CC#CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB1240 [0,2,0,0,0,0|2,0,0]=4 618 B14R1.29 CC#CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB1240 [0,2,0,0,0,0|2,0,0]=4 619 B14R1.29 CC(NC(=O)CC#N)c1ccccn1 WXVL_AK0585SB0057 [0,2,0,0,0,0|2,0,0]=4 620 B14R1.29 CC(NC(=O)CC#N)c1ccccn1 WXVL_AK0585SB0057 [0,2,0,0,0,0|2,0,0]=4 621 B14R1.29 CC(NC(=O)CC#N)c1ccncc1 WXVL_AK0282SB0057 [0,2,0,0,0,0|2,0,0]=4 622 B14R1.29 CC(NC(=O)CC#N)c1ccncc1 WXVL_AK0282SB0057 [0,2,0,0,0,0|2,0,0]=4 623 B14R1.29 CCCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0073 [0,2,0,0,0,0|2,0,0]=4 624 B14R1.29 CCCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0073 [0,2,0,0,0,0|2,0,0]=4 625 B14R1.29 CCCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0073 [0,2,0,0,0,0|2,0,0]=4 626 B14R1.29 CCCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0073 [0,2,0,0,0,0|2,0,0]=4 627 B14R1.29 CCCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0073 [0,2,0,0,0,0|2,0,0]=4 628 B14R1.29 CCCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0073 [0,2,0,0,0,0|2,0,0]=4 629 B14R1.29 CCCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0073 [0,2,0,0,0,0|2,0,0]=4 630 B14R1.29 CCCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0073 [0,2,0,0,0,0|2,0,0]=4 631 B14R1.29 CCCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0073 [0,2,0,0,0,0|2,0,0]=4 632 B14R1.29 CCCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0073 [0,2,0,0,0,0|2,0,0]=4 633 B14R1.29 CCCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0073 [0,2,0,0,0,0|2,0,0]=4 634 B14R1.29 CCCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0073 [0,2,0,0,0,0|2,0,0]=4 635 B14R1.29 CCNC(=O)CC(C)c1ccccc1 WXVL_AK00476SB0419 [0,2,0,0,0,0|1,0,0]=3 636 B14R1.29 CCNC(=O)CC(C)c1ccccc1 WXVL_AK00476SB0419 [0,2,0,0,0,0|1,0,0]=3 637 B14R1.29 CCNC(=O)CC(O)c1ccccc1 WXVL_AK00476SB2325 [0,2,0,0,0,0|2,0,0]=4 638 B14R1.29 CCNC(=O)CC(O)c1ccccc1 WXVL_AK00476SB2325 [0,2,0,0,0,0|2,0,0]=4 639 B14R1.29 CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00476YV0029 [0,2,0,0,0,0|1,0,0]=3 640 B14R1.29 CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00476YV0029 [0,2,0,0,0,0|1,0,0]=3 641 B14R1.29 CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00476YV0061 [0,2,0,0,0,0|1,0,0]=3 642 B14R1.29 CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00476YV0061 [0,2,0,0,0,0|1,0,0]=3 643 B14R1.29 COCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0090 [0,2,0,0,0,0|2,0,0]=4 644 B14R1.29 COCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0090 [0,2,0,0,0,0|2,0,0]=4 645 B14R1.29 COCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0090 [0,2,0,0,0,0|2,0,0]=4 646 B14R1.29 COCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0090 [0,2,0,0,0,0|2,0,0]=4 647 B14R1.29 COCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0090 [0,2,0,0,0,0|2,0,0]=4 648 B14R1.29 COCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0090 [0,2,0,0,0,0|2,0,0]=4 649 B14R1.29 COCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0090 [0,2,0,0,0,0|2,0,0]=4 650 B14R1.29 COCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0090 [0,2,0,0,0,0|2,0,0]=4 651 B14R1.29 COCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0090 [0,2,0,0,0,0|2,0,0]=4 652 B14R1.29 COCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0090 [0,2,0,0,0,0|2,0,0]=4 653 B14R1.29 COCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0090 [0,2,0,0,0,0|2,0,0]=4 654 B14R1.29 COCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0090 [0,2,0,0,0,0|2,0,0]=4 655 B14R1.29 CSCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB1267 [0,2,0,0,0,0|2,0,0]=4 656 B14R1.29 CSCC(=O)NC(C)c1ccccn1 WXVL_AK0585SB1267 [0,2,0,0,0,0|2,0,0]=4 657 B14R1.29 CSCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB1267 [0,2,0,0,0,0|2,0,0]=4 658 B14R1.29 CSCC(=O)NC(C)c1ccncc1 WXVL_AK0282SB1267 [0,2,0,0,0,0|2,0,0]=4 659 B14R1.29 CSCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB1267 [0,2,0,0,0,0|2,0,0]=4 660 B14R1.29 CSCC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB1267 [0,2,0,0,0,0|2,0,0]=4 661 B14R1.29 CSCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB1267 [0,2,0,0,0,0|2,0,0]=4 662 B14R1.29 CSCC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB1267 [0,2,0,0,0,0|2,0,0]=4 663 B14R1.29 CSCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB1267 [0,2,0,0,0,0|2,0,0]=4 664 B14R1.29 CSCC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB1267 [0,2,0,0,0,0|2,0,0]=4 665 B14R1.29 CSCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB1267 [0,2,0,0,0,0|2,0,0]=4 666 B14R1.29 CSCC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB1267 [0,2,0,0,0,0|2,0,0]=4 667 B14R1.29 C[C@@H](NC(=O)CC#N)c1ccccn1 WXVL_AK1519SB0057 [0,2,0,0,0,0|2,0,0]=4 668 B14R1.29 C[C@@H](NC(=O)CC#N)c1ccccn1 WXVL_AK1519SB0057 [0,2,0,0,0,0|2,0,0]=4 669 B14R1.29 C[C@@H](NC(=O)CC#N)c1cccnc1 WXVL_AK00154SB0057 [0,2,0,0,0,0|2,0,0]=4 670 B14R1.29 C[C@@H](NC(=O)CC#N)c1cccnc1 WXVL_AK00154SB0057 [0,2,0,0,0,0|2,0,0]=4 671 B14R1.29 C[C@H](NC(=O)CC#N)c1ccccn1 WXVL_AK00388SB0057 [0,2,0,0,0,0|2,0,0]=4 672 B14R1.29 C[C@H](NC(=O)CC#N)c1ccccn1 WXVL_AK00388SB0057 [0,2,0,0,0,0|2,0,0]=4 673 B14R1.29 C[C@H](NC(=O)CC#N)c1cccnc1 WXVL_AK3888SB0057 [0,2,0,0,0,0|2,0,0]=4 674 B14R1.29 C[C@H](NC(=O)CC#N)c1cccnc1 WXVL_AK3888SB0057 [0,2,0,0,0,0|2,0,0]=4 675 B14R1.587 C#CC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0338 [0,2,0,0,0,0|1,0,1]=4 676 B14R1.587 C#CC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0338 [0,2,0,0,0,0|1,0,1]=4 677 B14R1.587 C#CC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0338 [0,2,0,0,0,0|1,0,1]=4 678 B14R1.587 C#CC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0338 [0,2,0,0,0,0|1,0,1]=4 679 B14R1.587 C#CC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0338 [0,2,0,0,0,0|1,0,1]=4 680 B14R1.587 C#CC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0338 [0,2,0,0,0,0|1,0,1]=4 681 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0338 [0,2,0,0,0,0|1,0,1]=4 682 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0338 [0,2,0,0,0,0|1,0,1]=4 683 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0338 [0,2,0,0,0,0|1,0,1]=4 684 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0338 [0,2,0,0,0,0|1,0,1]=4 685 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0338 [0,2,0,0,0,0|1,0,1]=4 686 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0338 [0,2,0,0,0,0|1,0,1]=4 687 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0338 [0,2,0,0,0,0|1,0,1]=4 688 B14R1.587 C#CC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0338 [0,2,0,0,0,0|1,0,1]=4 689 B14R1.587 CC(NC(=O)CO)c1ccccc1Br WXVL_AK2261SB2706 [0,2,0,0,0,0|1,0,0]=3 690 B14R1.587 CC(NC(=O)CO)c1ccccc1Br WXVL_AK2261SB2706 [0,2,0,0,0,0|1,0,0]=3 691 B14R1.587 CC(NC(=O)CO)c1ccccc1Cl WXVL_AK3561SB2706 [0,2,0,0,0,0|1,0,0]=3 692 B14R1.587 CC(NC(=O)CO)c1ccccc1Cl WXVL_AK3561SB2706 [0,2,0,0,0,0|1,0,0]=3 693 B14R1.587 CC(NC(=O)CO)c1ccccc1F WXVL_AK0973SB2706 [0,2,0,0,0,0|1,0,0]=3 694 B14R1.587 CC(NC(=O)CO)c1ccccc1F WXVL_AK0973SB2706 [0,2,0,0,0,0|1,0,0]=3 695 B14R1.587 CCC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0064 [0,2,0,0,0,0|1,0,0]=3 696 B14R1.587 CCC(=O)NC(C)c1ccccc1Br WXVL_AK2261SB0064 [0,2,0,0,0,0|1,0,0]=3 697 B14R1.587 CCC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0064 [0,2,0,0,0,0|1,0,0]=3 698 B14R1.587 CCC(=O)NC(C)c1ccccc1Cl WXVL_AK3561SB0064 [0,2,0,0,0,0|1,0,0]=3 699 B14R1.587 CCC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0064 [0,2,0,0,0,0|1,0,0]=3 700 B14R1.587 CCC(=O)NC(C)c1ccccc1F WXVL_AK0973SB0064 [0,2,0,0,0,0|1,0,0]=3 701 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0064 [0,2,0,0,0,0|1,0,0]=3 702 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1C WXVL_AK00633SB0064 [0,2,0,0,0,0|1,0,0]=3 703 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0064 [0,2,0,0,0,0|1,0,0]=3 704 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1Cl WXVL_AK00789SB0064 [0,2,0,0,0,0|1,0,0]=3 705 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0064 [0,2,0,0,0,0|1,0,0]=3 706 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1F WXVL_AK00726SB0064 [0,2,0,0,0,0|1,0,0]=3 707 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0064 [0,2,0,0,0,0|1,0,0]=3 708 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1O WXVL_AK3644SB0064 [0,2,0,0,0,0|1,0,0]=3 709 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1Cl WXVL_AK00789SB2706 [0,2,0,0,0,0|1,0,0]=3 710 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1Cl WXVL_AK00789SB2706 [0,2,0,0,0,0|1,0,0]=3 711 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1F WXVL_AK00726SB2706 [0,2,0,0,0,0|1,0,0]=3 712 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1F WXVL_AK00726SB2706 [0,2,0,0,0,0|1,0,0]=3 713 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1O WXVL_AK3644SB2706 [0,2,0,0,0,0|1,0,0]=3 714 B14R1.587 C[C@@H](NC(=O)CO)c1ccccc1O WXVL_AK3644SB2706 [0,2,0,0,0,0|1,0,0]=3 715 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)CO WXVL_AK00633SB2706 [0,2,0,0,0,0|1,0,0]=3 716 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)CO WXVL_AK00633SB2706 [0,2,0,0,0,0|1,0,0]=3 717 B14R1.741 C#CC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0338 [0,2,0,0,0,0|1,0,1]=4 718 B14R1.741 C#CC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0338 [0,2,0,0,0,0|1,0,1]=4 719 B14R1.741 CC(C)(NC(=O)CO)c1ccccc1 WXVL_AK0415SB2706 [0,2,0,0,0,0|1,0,0]=3 720 B14R1.741 CC(C)(NC(=O)CO)c1ccccc1 WXVL_AK0415SB2706 [0,2,0,0,0,0|1,0,0]=3 721 B14R1.741 CC(C)(NC(=O)CO)c1ccccn1 WXVL_AK3657SB2706 [0,2,0,0,0,0|2,0,0]=4 722 B14R1.741 CC(C)(NC(=O)CO)c1ccccn1 WXVL_AK3657SB2706 [0,2,0,0,0,0|2,0,0]=4 723 B14R1.741 CC(C)(NC(=O)CO)c1ccncc1 WXVL_AK4008SB2706 [0,2,0,0,0,0|2,0,0]=4 724 B14R1.741 CC(C)(NC(=O)CO)c1ccncc1 WXVL_AK4008SB2706 [0,2,0,0,0,0|2,0,0]=4 725 B14R1.741 CCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0064 [0,2,0,0,0,0|1,0,0]=3 726 B14R1.741 CCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0064 [0,2,0,0,0,0|1,0,0]=3 727 B14R1.741 CCC(=O)NC(C)(C)c1ccccn1 WXVL_AK3657SB0064 [0,2,0,0,0,0|2,0,0]=4 728 B14R1.741 CCC(=O)NC(C)(C)c1ccccn1 WXVL_AK3657SB0064 [0,2,0,0,0,0|2,0,0]=4 729 B14R1.741 CCC(=O)NC(C)(C)c1ccncc1 WXVL_AK4008SB0064 [0,2,0,0,0,0|2,0,0]=4 730 B14R1.741 CCC(=O)NC(C)(C)c1ccncc1 WXVL_AK4008SB0064 [0,2,0,0,0,0|2,0,0]=4 731 B14R1.741 CNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00442SB0461 [0,2,0,0,0,0|1,0,0]=3 732 B14R1.741 CNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00442SB0461 [0,2,0,0,0,0|1,0,0]=3 733 B14R1.3297 C#CC(=O)N[C@@H](CC)c1ccccc1 WXVL_AK00525SB0338 [0,2,0,0,0,0|1,0,1]=4 734 B14R1.3297 C#CC(=O)N[C@@H](CC)c1ccccc1 WXVL_AK00525SB0338 [0,2,0,0,0,0|1,0,1]=4 735 B14R1.3297 C#CC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0338 [0,2,0,0,0,0|1,0,1]=4 736 B14R1.3297 C#CC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0338 [0,2,0,0,0,0|1,0,1]=4 737 B14R1.3297 C#CC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0338 [0,2,0,0,0,0|1,0,1]=4 738 B14R1.3297 C#CC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0338 [0,2,0,0,0,0|1,0,1]=4 739 B14R1.3297 CCC(=O)NC(C#N)c1ccccc1 WXVL_AK00665SB0064 [0,2,0,0,0,0|1,0,1]=4 740 B14R1.3297 CCC(=O)NC(C#N)c1ccccc1 WXVL_AK00665SB0064 [0,2,0,0,0,0|1,0,1]=4 741 B14R1.3297 CCC(=O)NC(CC)c1cccnc1 WXVL_AK00757SB0064 [0,2,0,0,0,0|2,0,0]=4 742 B14R1.3297 CCC(=O)NC(CC)c1cccnc1 WXVL_AK00757SB0064 [0,2,0,0,0,0|2,0,0]=4 743 B14R1.3297 CCC(=O)NC(CC)c1ccncc1 WXVL_AK2375SB0064 [0,2,0,0,0,0|2,0,0]=4 744 B14R1.3297 CCC(=O)NC(CC)c1ccncc1 WXVL_AK2375SB0064 [0,2,0,0,0,0|2,0,0]=4 745 B14R1.3297 CCC(=O)NC(CO)c1ccccn1 WXVL_AK00572SB0064 [0,2,0,0,0,0|2,0,0]=4 746 B14R1.3297 CCC(=O)NC(CO)c1ccccn1 WXVL_AK00572SB0064 [0,2,0,0,0,0|2,0,0]=4 747 B14R1.3297 CCC(=O)N[C@@H](CC)c1ccccc1 WXVL_AK00525SB0064 [0,2,0,0,0,0|1,0,0]=3 748 B14R1.3297 CCC(=O)N[C@@H](CC)c1ccccc1 WXVL_AK00525SB0064 [0,2,0,0,0,0|1,0,0]=3 749 B14R1.3297 CCC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0064 [0,2,0,0,0,0|1,0,0]=3 750 B14R1.3297 CCC(=O)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB0064 [0,2,0,0,0,0|1,0,0]=3 751 B14R1.3297 CCC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0064 [0,2,0,0,0,0|1,0,0]=3 752 B14R1.3297 CCC(=O)N[C@H](CO)c1ccccc1 WXVL_AK0108SB0064 [0,2,0,0,0,0|1,0,0]=3 753 B14R1.3297 CCC(NC(=O)CO)c1cccnc1 WXVL_AK00757SB2706 [0,2,0,0,0,0|2,0,0]=4 754 B14R1.3297 CCC(NC(=O)CO)c1cccnc1 WXVL_AK00757SB2706 [0,2,0,0,0,0|2,0,0]=4 755 B14R1.3297 CCC(NC(=O)CO)c1ccncc1 WXVL_AK2375SB2706 [0,2,0,0,0,0|2,0,0]=4 756 B14R1.3297 CCC(NC(=O)CO)c1ccncc1 WXVL_AK2375SB2706 [0,2,0,0,0,0|2,0,0]=4 757 B14R1.3297 CC[C@H](NC(=O)CO)c1ccccc1 WXVL_AK00525SB2706 [0,2,0,0,0,0|1,0,0]=3 758 B14R1.3297 CC[C@H](NC(=O)CO)c1ccccc1 WXVL_AK00525SB2706 [0,2,0,0,0,0|1,0,0]=3 759 B14R1.3297 N#CC(NC(=O)CO)c1ccccc1 WXVL_AK00665SB2706 [0,2,0,0,0,0|1,0,1]=4 760 B14R1.3297 N#CC(NC(=O)CO)c1ccccc1 WXVL_AK00665SB2706 [0,2,0,0,0,0|1,0,1]=4 761 B14R1.3297 O=C(CO)NC(CO)c1ccccn1 WXVL_AK00572SB2706 [0,2,0,0,0,0|2,0,0]=4 762 B14R1.3297 O=C(CO)NC(CO)c1ccccn1 WXVL_AK00572SB2706 [0,2,0,0,0,0|2,0,0]=4 763 B14R1.3297 O=C(CO)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB2706 [0,2,0,0,0,0|1,0,0]=3 764 B14R1.3297 O=C(CO)N[C@@H](CO)c1ccccc1 WXVL_AK00486SB2706 [0,2,0,0,0,0|1,0,0]=3 765 B14R1.3297 O=C(CO)N[C@H](CO)c1ccccc1 WXVL_AK0108SB2706 [0,2,0,0,0,0|1,0,0]=3 766 B14R1.3297 O=C(CO)N[C@H](CO)c1ccccc1 WXVL_AK0108SB2706 [0,2,0,0,0,0|1,0,0]=3 767 B14R1.2 CC(=O)NC(C)c1ccc(cc1)C#N WXVL_AK00722SB0150 [0,2,0,0,0,0|1,0,0]=3 768 B14R1.2 CC(=O)NC(C)c1ccc(cc1)C#N WXVL_AK00722SB0150 [0,2,0,0,0,0|1,0,0]=3 769 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N WXVL_AK0354SB0150 [0,2,0,0,0,0|1,0,0]=3 770 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N WXVL_AK0354SB0150 [0,2,0,0,0,0|1,0,0]=3 771 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)CO WXVL_AK8555SB0150 [0,2,0,0,0,0|1,0,0]=3 772 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)CO WXVL_AK8555SB0150 [0,2,0,0,0,0|1,0,0]=3 773 B14R1.2 COc1ccc(cc1)C(C)NC(=O)C WXVL_AK00737SB0150 [0,2,0,0,0,0|1,0,0]=3 774 B14R1.2 COc1ccc(cc1)C(C)NC(=O)C WXVL_AK00737SB0150 [0,2,0,0,0,0|1,0,0]=3 775 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C WXVL_AK0773SB0150 [0,2,0,0,0,0|1,0,0]=3 776 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C WXVL_AK0773SB0150 [0,2,0,0,0,0|1,0,0]=3 777 B14R1.2 CSc1ccc(cc1)[C@H](C)NC(=O)C WXVL_AK00663SB0150 [0,2,0,0,0,0|1,0,0]=3 778 B14R1.2 CSc1ccc(cc1)[C@H](C)NC(=O)C WXVL_AK00663SB0150 [0,2,0,0,0,0|1,0,0]=3 779 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)Br WXVL_AK00786SB0150 [0,2,0,0,0,0|1,0,0]=3 780 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)Br WXVL_AK00786SB0150 [0,2,0,0,0,0|1,0,0]=3 781 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)C WXVL_AK6338SB0150 [0,2,0,0,0,0|1,0,0]=3 782 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)C WXVL_AK6338SB0150 [0,2,0,0,0,0|1,0,0]=3 783 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)F WXVL_AK00692SB0150 [0,2,0,0,0,0|1,0,0]=3 784 B14R1.685 CC(=O)N[C@@H](C)c1ccc(c(c1)F)F WXVL_AK00692SB0150 [0,2,0,0,0,0|1,0,0]=3 785 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)Cl)C WXVL_AK00350SB0150 [0,2,0,0,0,0|1,0,0]=3 786 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)Cl)C WXVL_AK00350SB0150 [0,2,0,0,0,0|1,0,0]=3 787 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)Cl)Cl WXVL_AK00750SB0150 [0,2,0,0,0,0|1,0,0]=3 788 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)Cl)Cl WXVL_AK00750SB0150 [0,2,0,0,0,0|1,0,0]=3 789 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)F)Cl WXVL_AK00721SB0150 [0,2,0,0,0,0|1,0,0]=3 790 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)F)Cl WXVL_AK00721SB0150 [0,2,0,0,0,0|1,0,0]=3 791 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)F)F WXVL_AK3324SB0150 [0,2,0,0,0,0|1,0,0]=3 792 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)F)F WXVL_AK3324SB0150 [0,2,0,0,0,0|1,0,0]=3 793 B14R1.1019 CC(=O)NC(CO)c1ccc(cc1)C WXVL_AK6370SB0150 [0,2,0,0,0,0|1,0,0]=3 794 B14R1.1019 CC(=O)NC(CO)c1ccc(cc1)C WXVL_AK6370SB0150 [0,2,0,0,0,0|1,0,0]=3 795 B14R1.1019 CC(=O)NC(CO)c1ccc(cc1)F WXVL_AK00394SB0150 [0,2,0,0,0,0|1,0,0]=3 796 B14R1.1019 CC(=O)NC(CO)c1ccc(cc1)F WXVL_AK00394SB0150 [0,2,0,0,0,0|1,0,0]=3 797 B14R1.1019 CC(=O)N[C@@H](CO)c1ccc(cc1)Br WXVL_AK00368SB0150 [0,2,0,0,0,0|1,0,0]=3 798 B14R1.1019 CC(=O)N[C@@H](CO)c1ccc(cc1)Br WXVL_AK00368SB0150 [0,2,0,0,0,0|1,0,0]=3 799 B14R1.1019 CC(=O)N[C@@H](CO)c1ccc(cc1)O WXVL_AK00379SB0150 [0,2,0,0,0,0|1,0,0]=3 800 B14R1.1019 CC(=O)N[C@@H](CO)c1ccc(cc1)O WXVL_AK00379SB0150 [0,2,0,0,0,0|1,0,0]=3 801 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)Br WXVL_AK00589SB0150 [0,2,0,0,0,0|1,0,0]=3 802 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)Br WXVL_AK00589SB0150 [0,2,0,0,0,0|1,0,0]=3 803 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)Cl WXVL_AK00401SB0150 [0,2,0,0,0,0|1,0,0]=3 804 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)Cl WXVL_AK00401SB0150 [0,2,0,0,0,0|1,0,0]=3 805 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)F WXVL_AK00505SB0150 [0,2,0,0,0,0|1,0,0]=3 806 B14R1.1019 CC(=O)N[C@H](CO)c1ccc(cc1)F WXVL_AK00505SB0150 [0,2,0,0,0,0|1,0,0]=3 807 B14R1.1019 CC[C@H](NC(=O)C)c1ccc(cc1)Br WXVL_AK00373SB0150 [0,2,0,0,0,0|1,0,0]=3 808 B14R1.1019 CC[C@H](NC(=O)C)c1ccc(cc1)Br WXVL_AK00373SB0150 [0,2,0,0,0,0|1,0,0]=3 809 B14R1.6048 CC(=O)NC(C)c1ccc(cc1Cl)Cl WXVL_AK6004SB0150 [0,2,0,0,0,0|1,0,0]=3 810 B14R1.6048 CC(=O)NC(C)c1ccc(cc1Cl)Cl WXVL_AK6004SB0150 [0,2,0,0,0,0|1,0,0]=3 811 B14R1.6048 CC(=O)N[C@@H](C)c1ccc(cc1F)F WXVL_AK1448SB0150 [0,2,0,0,0,0|1,0,0]=3 812 B14R1.6048 CC(=O)N[C@@H](C)c1ccc(cc1F)F WXVL_AK1448SB0150 [0,2,0,0,0,0|1,0,0]=3 813 B14R1.74 CC(=O)N[C@H](C)c1cccc(c1)C#N WXVL_AK00696SB0150 [0,2,0,0,0,0|1,0,0]=3 814 B14R1.74 CC(=O)N[C@H](C)c1cccc(c1)C#N WXVL_AK00696SB0150 [0,2,0,0,0,0|1,0,0]=3 815 B14R1.74 COc1cccc(c1)[C@@H](C)NC(=O)C WXVL_AK00514SB0150 [0,2,0,0,0,0|1,0,0]=3 816 B14R1.74 COc1cccc(c1)[C@@H](C)NC(=O)C WXVL_AK00514SB0150 [0,2,0,0,0,0|1,0,0]=3 817 B14R1.150 CC(=O)C(=O)N(C)c1cccc(c1)N WXVL_AG3393SB0051 [0,2,0,0,0,0|2,0,0]=4 818 B14R1.150 CC(=O)C(=O)N(C)c1cccc(c1)N WXVL_AG3393SB0051 [0,2,0,0,0,0|2,0,0]=4 819 B14R1.152 CC(=O)NC(C)c1cccc(c1Cl)Cl WXVL_AK00647SB0150 [0,2,0,0,0,0|1,0,0]=3 820 B14R1.152 CC(=O)NC(C)c1cccc(c1Cl)Cl WXVL_AK00647SB0150 [0,2,0,0,0,0|1,0,0]=3 821 B14R1.152 CC(=O)N[C@H](C)c1cccc(c1F)Cl WXVL_AK00753SB0150 [0,2,0,0,0,0|1,0,0]=3 822 B14R1.152 CC(=O)N[C@H](C)c1cccc(c1F)Cl WXVL_AK00753SB0150 [0,2,0,0,0,0|1,0,0]=3 823 B14R1.152 CC(=O)N[C@H](C)c1cccc(c1F)F WXVL_AK4917SB0150 [0,2,0,0,0,0|1,0,0]=3 824 B14R1.152 CC(=O)N[C@H](C)c1cccc(c1F)F WXVL_AK4917SB0150 [0,2,0,0,0,0|1,0,0]=3 825 B14R1.1020 CC(=O)NC(CO)c1cccc(c1)O WXVL_AK00632SB0150 [0,2,0,0,0,0|1,0,0]=3 826 B14R1.1020 CC(=O)NC(CO)c1cccc(c1)O WXVL_AK00632SB0150 [0,2,0,0,0,0|1,0,0]=3 827 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)Br WXVL_AK3770SB0150 [0,2,0,0,0,0|1,0,0]=3 828 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)Br WXVL_AK3770SB0150 [0,2,0,0,0,0|1,0,0]=3 829 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)Cl WXVL_AK2910SB0150 [0,2,0,0,0,0|1,0,0]=3 830 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)Cl WXVL_AK2910SB0150 [0,2,0,0,0,0|1,0,0]=3 831 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)F WXVL_AK00807SB0150 [0,2,0,0,0,0|1,0,0]=3 832 B14R1.1020 CC(=O)N[C@@H](CO)c1cccc(c1)F WXVL_AK00807SB0150 [0,2,0,0,0,0|1,0,0]=3 833 B14R1.1020 CC(=O)N[C@H](CO)c1cccc(c1)C WXVL_AK00376SB0150 [0,2,0,0,0,0|1,0,0]=3 834 B14R1.1020 CC(=O)N[C@H](CO)c1cccc(c1)C WXVL_AK00376SB0150 [0,2,0,0,0,0|1,0,0]=3 835 B14R1.1020 CC(=O)N[C@H](CO)c1cccc(c1)F WXVL_AK5582SB0150 [0,2,0,0,0,0|1,0,0]=3 836 B14R1.1020 CC(=O)N[C@H](CO)c1cccc(c1)F WXVL_AK5582SB0150 [0,2,0,0,0,0|1,0,0]=3 837 B14R1.4252 CC(=O)N[C@@H](C)c1cc(cc(c1)C)C WXVL_AK00322SB0150 [0,2,0,0,0,0|1,0,0]=3 838 B14R1.4252 CC(=O)N[C@@H](C)c1cc(cc(c1)C)C WXVL_AK00322SB0150 [0,2,0,0,0,0|1,0,0]=3 839 B14R1.4252 CC(=O)N[C@@H](C)c1cc(cc(c1)F)F WXVL_AK00593SB0150 [0,2,0,0,0,0|1,0,0]=3 840 B14R1.4252 CC(=O)N[C@@H](C)c1cc(cc(c1)F)F WXVL_AK00593SB0150 [0,2,0,0,0,0|1,0,0]=3 841 B14R1.4252 CC(=O)N[C@H](C)c1cc(cc(c1)Cl)F WXVL_AK00713SB0150 [0,2,0,0,0,0|1,0,0]=3 842 B14R1.4252 CC(=O)N[C@H](C)c1cc(cc(c1)Cl)F WXVL_AK00713SB0150 [0,2,0,0,0,0|1,0,0]=3 843 B14R1.4252 CC(=O)N[C@H](C)c1cc(cc(c1)F)F WXVL_AK00169SB0150 [0,2,0,0,0,0|1,0,0]=3 844 B14R1.4252 CC(=O)N[C@H](C)c1cc(cc(c1)F)F WXVL_AK00169SB0150 [0,2,0,0,0,0|1,0,0]=3 845 B14R1.6052 CC(=O)N[C@@H](C)c1cc(ccc1O)Cl WXVL_AK00610SB0150 [0,2,0,0,0,0|1,0,0]=3 846 B14R1.6052 CC(=O)N[C@@H](C)c1cc(ccc1O)Cl WXVL_AK00610SB0150 [0,2,0,0,0,0|1,0,0]=3 847 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C WXVL_AN3784SB0150 [0,2,0,0,0,0|1,0,0]=3 848 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C WXVL_AN3784SB0150 [0,2,0,0,0,0|1,0,0]=3 849 B14R1.840 COc1ccccc1[C@@H](C)NC(=O)C WXVL_AK3559SB0150 [0,2,0,0,0,0|1,0,0]=3 850 B14R1.840 COc1ccccc1[C@@H](C)NC(=O)C WXVL_AK3559SB0150 [0,2,0,0,0,0|1,0,0]=3 851 B14R1.5958 CC(=O)NC(C)c1c(cccc1F)F WXVL_AK3837SB0150 [0,2,0,0,0,0|1,0,0]=3 852 B14R1.5958 CC(=O)NC(C)c1c(cccc1F)F WXVL_AK3837SB0150 [0,2,0,0,0,0|1,0,0]=3 853 B14R1.6474 CC(=O)NC(CO)c1ccccc1Cl WXVL_AK2675SB0150 [0,2,0,0,0,0|1,0,0]=3 854 B14R1.6474 CC(=O)NC(CO)c1ccccc1Cl WXVL_AK2675SB0150 [0,2,0,0,0,0|1,0,0]=3 855 B14R1.6474 CC(=O)N[C@@H](CO)c1ccccc1F WXVL_AK00638SB0150 [0,2,0,0,0,0|1,0,0]=3 856 B14R1.6474 CC(=O)N[C@@H](CO)c1ccccc1F WXVL_AK00638SB0150 [0,2,0,0,0,0|1,0,0]=3 857 B14R1.6474 CCC(NC(=O)C)c1ccccc1F WXVL_AK00384SB0150 [0,2,0,0,0,0|1,0,0]=3 858 B14R1.6474 CCC(NC(=O)C)c1ccccc1F WXVL_AK00384SB0150 [0,2,0,0,0,0|1,0,0]=3 859 B14R1.6474 CC[C@H](NC(=O)C)c1ccccc1Cl WXVL_AK00171SB0150 [0,2,0,0,0,0|1,0,0]=3 860 B14R1.6474 CC[C@H](NC(=O)C)c1ccccc1Cl WXVL_AK00171SB0150 [0,2,0,0,0,0|1,0,0]=3 861 B14R1.515 CC(=O)NC(CCO)c1ccccc1 WXVL_AK0797SB0150 [0,2,0,0,0,0|1,0,0]=3 862 B14R1.515 CC(=O)NC(CCO)c1ccccc1 WXVL_AK0797SB0150 [0,2,0,0,0,0|1,0,0]=3 863 B14R1.515 CCC[C@@H](NC(=O)C)c1ccccc1 WXVL_AK5856SB0150 [0,2,0,0,0,0|1,0,0]=3 864 B14R1.515 CCC[C@@H](NC(=O)C)c1ccccc1 WXVL_AK5856SB0150 [0,2,0,0,0,0|1,0,0]=3 865 B14R1.515 COC[C@@H](NC(=O)C)c1ccccc1 WXVL_AK7470SB0150 [0,2,0,0,0,0|1,0,0]=3 866 B14R1.515 COC[C@@H](NC(=O)C)c1ccccc1 WXVL_AK7470SB0150 [0,2,0,0,0,0|1,0,0]=3 867 B14R1.515 COC[C@H](NC(=O)C)c1ccccc1 WXVL_AK4386SB0150 [0,2,0,0,0,0|1,0,0]=3 868 B14R1.515 COC[C@H](NC(=O)C)c1ccccc1 WXVL_AK4386SB0150 [0,2,0,0,0,0|1,0,0]=3 869 B14R1.6455 CC(=O)NC(C(=O)N)c1ccccc1 WXVL_AK0084SB4308 [0,2,0,0,0,0|1,0,1]=4 870 B14R1.6455 CC(=O)NC(C(=O)N)c1ccccc1 WXVL_AK0084SB4308 [0,2,0,0,0,0|1,0,1]=4 871 B14R1.6455 CC(=O)NC(c1ccccn1)C(C)C WXVL_AK6555SB0150 [0,2,0,0,0,0|2,0,0]=4 872 B14R1.6455 CC(=O)NC(c1ccccn1)C(C)C WXVL_AK6555SB0150 [0,2,0,0,0,0|2,0,0]=4 873 B14R1.6455 CC(=O)NC(c1cccnc1)C(C)C WXVL_AK6442SB0150 [0,2,0,0,0,0|2,0,0]=4 874 B14R1.6455 CC(=O)NC(c1cccnc1)C(C)C WXVL_AK6442SB0150 [0,2,0,0,0,0|2,0,0]=4 875 B14R1.6455 CC(=O)N[C@@H](c1ccccc1)C(C)C WXVL_AK00356SB0150 [0,2,0,0,0,0|1,0,0]=3 876 B14R1.6455 CC(=O)N[C@@H](c1ccccc1)C(C)C WXVL_AK00356SB0150 [0,2,0,0,0,0|1,0,0]=3 877 B14R1.6455 CC(=O)N[C@H](C(=O)N)c1ccccc1 WXVL_AK1505SB0150 [0,2,0,0,0,0|1,0,1]=4 878 B14R1.6455 CC(=O)N[C@H](C(=O)N)c1ccccc1 WXVL_AK1505SB0150 [0,2,0,0,0,0|1,0,1]=4 879 B14R1.6455 CC(=O)O[C@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0520 [0,2,0,0,0,0|0,0,1]=3 880 B14R1.6455 CC(=O)O[C@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0520 [0,2,0,0,0,0|0,0,1]=3 881 B14R2.768 NC(=O)CC1Cc2ccccc2C1 WXVL_AK0084SB0756 [0,0,0,1,0,1|2,0,0]=4 882 B14R2.768 NC(=O)CC1Cc2ccccc2C1 WXVL_AK0084SB0756 [0,0,0,1,0,1|2,0,0]=4 883 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [0,1,0,1,0,0|1,0,0]=3 884 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [0,1,0,1,0,0|1,0,0]=3 885 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [0,1,0,1,0,0|1,0,0]=3 886 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [0,1,0,1,0,0|1,0,0]=3 887 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK0084SB0852 [0,1,0,1,0,0|2,0,0]=4 888 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK0084SB0852 [0,1,0,1,0,0|2,0,0]=4 889 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)F WXVL_AK0084SB3469 [0,1,0,1,0,0|2,0,0]=4 890 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)F WXVL_AK0084SB3469 [0,1,0,1,0,0|2,0,0]=4 891 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK0084SB6328 [0,1,0,1,0,0|2,0,0]=4 892 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK0084SB6328 [0,1,0,1,0,0|2,0,0]=4 893 B14R2.780 CC(=O)N1CCC1c2ccccc2 WXVL_AN3661SB0150 [0,1,0,1,0,0|1,0,0]=3 894 B14R2.2 CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB0150 [0,1,0,1,0,0|1,0,0]=3 895 B14R2.2 CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB0150 [0,1,0,1,0,0|1,0,0]=3 896 B14R2.2 CC(=O)NC1CCc2c1nccc2 WXVL_AK2236SB0150 [0,1,0,1,0,0|2,0,0]=4 897 B14R2.2 CC(=O)NC1CCc2c1nccc2 WXVL_AK2236SB0150 [0,1,0,1,0,0|2,0,0]=4 898 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,1,0,1,0,0|1,0,0]=3 899 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,1,0,1,0,0|1,0,0]=3 900 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB0150 [0,1,0,1,0,0|1,0,0]=3 901 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB0150 [0,1,0,1,0,0|1,0,0]=3 902 B14R2.1014 CC(=O)NC1(CC1)c2ccncc2 WXVL_AK00490SB0150 [0,1,0,1,0,0|2,0,0]=4 903 B14R2.1014 CC(=O)NC1(CC1)c2ccncc2 WXVL_AK00490SB0150 [0,1,0,1,0,0|2,0,0]=4 904 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [1,0,0,0,1,0|1,0,0]=3 905 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [1,0,0,0,1,0|1,0,0]=3 906 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [1,0,0,0,1,0|2,0,0]=4 907 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [1,0,0,0,1,0|2,0,0]=4 908 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [1,0,0,0,1,0|1,0,0]=3 909 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [1,0,0,0,1,0|1,0,0]=3 910 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [1,0,0,0,1,0|2,0,0]=4 911 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [1,0,0,0,1,0|2,0,0]=4 912 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [1,0,0,0,1,0|2,0,0]=4 913 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [1,0,0,0,1,0|2,0,0]=4 914 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [1,0,0,0,1,0|2,0,0]=4 915 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [1,0,0,0,1,0|2,0,0]=4 916 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [1,0,0,0,1,0|2,0,0]=4 917 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [1,0,0,0,1,0|2,0,0]=4 918 B10R1.66 CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0150 [1,0,0,0,1,0|2,0,0]=4 919 B10R1.66 CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0150 [1,0,0,0,1,0|2,0,0]=4 920 B10R1.66 CC(=O)NCc1ccco1 WXVL_AK0010SB0150 [1,0,0,0,1,0|2,0,0]=4 921 B10R1.66 CC(=O)NCc1ccco1 WXVL_AK0010SB0150 [1,0,0,0,1,0|2,0,0]=4 922 B10R1.66 CC(=O)NCc1cccs1 WXVL_AK0014SB0150 [1,0,0,0,1,0|2,0,0]=4 923 B10R1.66 CC(=O)NCc1cccs1 WXVL_AK0014SB0150 [1,0,0,0,1,0|2,0,0]=4 924 B10R1.66 CC(=O)NCc1ccoc1 WXVL_AK2033SB0150 [1,0,0,0,1,0|2,0,0]=4 925 B10R1.66 CC(=O)NCc1ccoc1 WXVL_AK2033SB0150 [1,0,0,0,1,0|2,0,0]=4 926 B10R1.66 CC(=O)NCc1ccsc1 WXVL_AK00174SB0150 [1,0,0,0,1,0|2,0,0]=4 927 B10R1.66 CC(=O)NCc1ccsc1 WXVL_AK00174SB0150 [1,0,0,0,1,0|2,0,0]=4 928 B10R1.23 CC(C(=O)N)c1cccs1 WXVL_AK0084SA1203 [0,0,0,0,2,0|2,0,0]=4 929 B10R1.23 CC(C(=O)N)c1cccs1 WXVL_AK0084SA1203 [0,0,0,0,2,0|2,0,0]=4 930 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [1,0,0,0,0,1|1,0,0]=3 931 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [1,0,0,0,0,1|1,0,0]=3 932 B12R1.252 CC(=O)NCCc1ccccn1 WXVL_AK0019SB0150 [1,0,0,0,0,1|2,0,0]=4 933 B12R1.252 CC(=O)NCCc1ccccn1 WXVL_AK0019SB0150 [1,0,0,0,0,1|2,0,0]=4 934 B12R1.252 CC(=O)NCCc1cccnc1 WXVL_AK00436SB0150 [1,0,0,0,0,1|2,0,0]=4 935 B12R1.252 CC(=O)NCCc1cccnc1 WXVL_AK00436SB0150 [1,0,0,0,0,1|2,0,0]=4 936 B12R1.252 CC(=O)NCCc1ccncc1 WXVL_AK0093SB0150 [1,0,0,0,0,1|2,0,0]=4 937 B12R1.252 CC(=O)NCCc1ccncc1 WXVL_AK0093SB0150 [1,0,0,0,0,1|2,0,0]=4 938 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [1,0,0,0,0,1|2,0,0]=4 939 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [1,0,0,0,0,1|2,0,0]=4 940 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [1,0,0,0,0,1|2,0,0]=4 941 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [1,0,0,0,0,1|2,0,0]=4 942 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [1,0,0,0,0,1|1,0,0]=3 943 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [1,0,0,0,0,1|1,0,0]=3 944 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [0,0,0,0,0,2|2,0,0]=4 945 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [0,0,0,0,0,2|2,0,0]=4 946 B14R1.423 CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB0150 [0,0,0,0,0,2|2,0,0]=4 947 B14R1.423 CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB0150 [0,0,0,0,0,2|2,0,0]=4 948 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,0,0,0,0,2|1,0,1]=4 949 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,0,0,0,0,2|1,0,1]=4