0 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.252 CC(=O)NCCc1ccccc1 WXVL_AK00498SB0150 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.252 CC(=O)NCCc1ccccn1 WXVL_AK0019SB0150 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.252 CC(=O)NCCc1ccccn1 WXVL_AK0019SB0150 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.252 CC(=O)NCCc1cccnc1 WXVL_AK00436SB0150 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.252 CC(=O)NCCc1cccnc1 WXVL_AK00436SB0150 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.252 CC(=O)NCCc1ccncc1 WXVL_AK0093SB0150 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.252 CC(=O)NCCc1ccncc1 WXVL_AK0093SB0150 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.252 CC(=O)NCCc1ccncn1 WXVL_AK6509SB0150 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.252 CC(=O)NCCc1ccncn1 WXVL_AK6509SB0150 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.252 NC(=O)CCCc1ccccc1 WXVL_AK0084SB0121 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [0,0,0,0,0,0|3,0,0]=3 13 B12R1.252 NC(=O)CCOc1ccccc1 WXVL_AK0084SB0066 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.252 NC(=O)COCc1ccccc1 WXVL_AK0084SB0185 [0,0,0,0,0,0|3,0,0]=3 16 B13R1.45 CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0150 [0,1,0,0,0,0|1,0,0]=2 17 B13R1.45 CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0150 [0,1,0,0,0,0|1,0,0]=2 18 B13R1.45 CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0150 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.45 CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0150 [0,1,0,0,0,0|1,0,0]=2 20 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0150 [0,1,0,0,0,0|1,0,0]=2 21 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0150 [0,1,0,0,0,0|1,0,0]=2 22 B13R1.149 CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0150 [0,1,0,0,0,0|1,0,0]=2 23 B13R1.149 CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0150 [0,1,0,0,0,0|1,0,0]=2 24 B13R1.149 CC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0150 [0,1,0,0,0,0|1,0,0]=2 25 B13R1.149 CC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0150 [0,1,0,0,0,0|1,0,0]=2 26 B13R1.149 CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0150 [0,1,0,0,0,0|1,0,0]=2 27 B13R1.149 CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0150 [0,1,0,0,0,0|1,0,0]=2 28 B13R1.149 CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0150 [0,1,0,0,0,0|1,0,0]=2 29 B13R1.149 CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0150 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.149 CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0150 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.149 CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0150 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.158 CC(=O)NCCc1ccccc1Br WXVL_AK0778SB0150 [0,1,0,0,0,0|1,0,0]=2 33 B13R1.158 CC(=O)NCCc1ccccc1Br WXVL_AK0778SB0150 [0,1,0,0,0,0|1,0,0]=2 34 B13R1.158 CC(=O)NCCc1ccccc1C WXVL_AK0254SB0150 [0,1,0,0,0,0|1,0,0]=2 35 B13R1.158 CC(=O)NCCc1ccccc1C WXVL_AK0254SB0150 [0,1,0,0,0,0|1,0,0]=2 36 B13R1.158 CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0150 [0,1,0,0,0,0|1,0,0]=2 37 B13R1.158 CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0150 [0,1,0,0,0,0|1,0,0]=2 38 B13R1.158 CC(=O)NCCc1ccccc1F WXVL_AK0118SB0150 [0,1,0,0,0,0|1,0,0]=2 39 B13R1.158 CC(=O)NCCc1ccccc1F WXVL_AK0118SB0150 [0,1,0,0,0,0|1,0,0]=2 40 B13R1.158 CC(=O)NCCc1ccccc1O WXVL_AK2884SB0150 [0,1,0,0,0,0|1,0,0]=2 41 B13R1.158 CC(=O)NCCc1ccccc1O WXVL_AK2884SB0150 [0,1,0,0,0,0|1,0,0]=2 42 B13R1.158 NC(=O)CCCc1ccccc1F WXVL_AK0084SB3843 [0,1,0,0,0,0|2,0,0]=3 43 B13R1.158 NC(=O)CCCc1ccccc1F WXVL_AK0084SB3843 [0,1,0,0,0,0|2,0,0]=3 44 B13R1.158 NC(=O)CCOc1ccccc1Br WXVL_AK0084SB6717 [0,1,0,0,0,0|3,0,0]=4 45 B13R1.158 NC(=O)CCOc1ccccc1Br WXVL_AK0084SB6717 [0,1,0,0,0,0|3,0,0]=4 46 B13R1.348 CC(CC(=O)N)Oc1ccccc1 WXVL_AK0084SA00047 [0,1,0,0,0,0|3,0,0]=4 47 B13R1.348 CC(CC(=O)N)Oc1ccccc1 WXVL_AK0084SA00047 [0,1,0,0,0,0|3,0,0]=4 48 B13R1.351 CC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0051 [0,1,0,0,0,0|2,0,0]=3 49 B13R1.351 CC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0051 [0,1,0,0,0,0|2,0,0]=3 50 B13R1.351 CC(=O)C(=O)NCc1ccccn1 WXVL_AK0018SB0051 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.351 CC(=O)C(=O)NCc1ccccn1 WXVL_AK0018SB0051 [0,1,0,0,0,0|3,0,0]=4 52 B13R1.351 CC(=O)C(=O)NCc1cccnc1 WXVL_AK0020SB0051 [0,1,0,0,0,0|3,0,0]=4 53 B13R1.351 CC(=O)C(=O)NCc1cccnc1 WXVL_AK0020SB0051 [0,1,0,0,0,0|3,0,0]=4 54 B13R1.351 CC(=O)C(=O)NCc1ccncc1 WXVL_AK0021SB0051 [0,1,0,0,0,0|3,0,0]=4 55 B13R1.351 CC(=O)C(=O)NCc1ccncc1 WXVL_AK0021SB0051 [0,1,0,0,0,0|3,0,0]=4 56 B13R1.351 CN(C)C(=O)CCc1ccccc1 WXVL_AN0032SB0067 [0,1,0,0,0,0|3,0,0]=4 57 B13R1.351 CN(C)C(=O)CCc1ccccc1 WXVL_AN0032SB0067 [0,1,0,0,0,0|3,0,0]=4 58 B13R1.351 NC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0128 [0,1,0,0,0,0|3,0,0]=4 59 B13R1.351 NC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0128 [0,1,0,0,0,0|3,0,0]=4 60 B13R1.513 CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0150 [0,1,0,0,0,0|1,0,0]=2 61 B13R1.513 CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0150 [0,1,0,0,0,0|1,0,0]=2 62 B13R1.513 CC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0150 [0,1,0,0,0,0|1,0,0]=2 63 B13R1.513 CC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0150 [0,1,0,0,0,0|1,0,0]=2 64 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0150 [0,1,0,0,0,0|1,0,0]=2 65 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0150 [0,1,0,0,0,0|1,0,0]=2 66 B13R1.513 CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0150 [0,1,0,0,0,0|1,0,0]=2 67 B13R1.513 CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0150 [0,1,0,0,0,0|1,0,0]=2 68 B13R1.513 CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0150 [0,1,0,0,0,0|1,0,0]=2 69 B13R1.513 CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0150 [0,1,0,0,0,0|1,0,0]=2 70 B13R1.513 CC(=O)NCCc1ncc(cn1)C WXVL_AK00290SB0150 [0,1,0,0,0,0|3,0,0]=4 71 B13R1.513 CC(=O)NCCc1ncc(cn1)C WXVL_AK00290SB0150 [0,1,0,0,0,0|3,0,0]=4 72 B13R1.513 Cc1ccc(cc1)OCCC(=O)N WXVL_AK0084SB0468 [0,1,0,0,0,0|3,0,0]=4 73 B13R1.513 Cc1ccc(cc1)OCCC(=O)N WXVL_AK0084SB0468 [0,1,0,0,0,0|3,0,0]=4 74 B13R1.513 NC(=O)CCCc1ccc(cc1)Br WXVL_AK0084SB4477 [0,1,0,0,0,0|2,0,0]=3 75 B13R1.513 NC(=O)CCCc1ccc(cc1)Br WXVL_AK0084SB4477 [0,1,0,0,0,0|2,0,0]=3 76 B13R1.513 NC(=O)CCCc1ccc(cc1)F WXVL_AK0084SB1490 [0,1,0,0,0,0|2,0,0]=3 77 B13R1.513 NC(=O)CCCc1ccc(cc1)F WXVL_AK0084SB1490 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.513 NC(=O)CCOc1ccc(cc1)Br WXVL_AK0084SB0800 [0,1,0,0,0,0|3,0,0]=4 79 B13R1.513 NC(=O)CCOc1ccc(cc1)Br WXVL_AK0084SB0800 [0,1,0,0,0,0|3,0,0]=4 80 B13R1.513 NC(=O)CCOc1ccc(cc1)F WXVL_AK0084SB0479 [0,1,0,0,0,0|3,0,0]=4 81 B13R1.513 NC(=O)CCOc1ccc(cc1)F WXVL_AK0084SB0479 [0,1,0,0,0,0|3,0,0]=4 82 B13R1.718 C#CC(=O)NCCc1ccccc1 WXVL_AK00498SB0338 [0,1,0,0,0,0|1,0,1]=3 83 B13R1.718 C#CC(=O)NCCc1ccccc1 WXVL_AK00498SB0338 [0,1,0,0,0,0|1,0,1]=3 84 B13R1.718 C#CC(=O)NCCc1ccccn1 WXVL_AK0019SB0338 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.718 C#CC(=O)NCCc1ccccn1 WXVL_AK0019SB0338 [0,1,0,0,0,0|2,0,1]=4 86 B13R1.718 C#CC(=O)NCCc1cccnc1 WXVL_AK00436SB0338 [0,1,0,0,0,0|2,0,1]=4 87 B13R1.718 C#CC(=O)NCCc1cccnc1 WXVL_AK00436SB0338 [0,1,0,0,0,0|2,0,1]=4 88 B13R1.718 C#CC(=O)NCCc1ccncc1 WXVL_AK0093SB0338 [0,1,0,0,0,0|2,0,1]=4 89 B13R1.718 C#CC(=O)NCCc1ccncc1 WXVL_AK0093SB0338 [0,1,0,0,0,0|2,0,1]=4 90 B13R1.718 CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0064 [0,1,0,0,0,0|1,0,0]=2 91 B13R1.718 CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0064 [0,1,0,0,0,0|1,0,0]=2 92 B13R1.718 CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0064 [0,1,0,0,0,0|2,0,0]=3 93 B13R1.718 CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0064 [0,1,0,0,0,0|2,0,0]=3 94 B13R1.718 CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0064 [0,1,0,0,0,0|2,0,0]=3 95 B13R1.718 CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0064 [0,1,0,0,0,0|2,0,0]=3 96 B13R1.718 CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0064 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.718 CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0064 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.718 CCC(=O)NCCc1ccncn1 WXVL_AK6509SB0064 [0,1,0,0,0,0|3,0,0]=4 99 B13R1.718 CCC(=O)NCCc1ccncn1 WXVL_AK6509SB0064 [0,1,0,0,0,0|3,0,0]=4 100 B13R1.718 CNC(=O)CCCc1ccccc1 WXVL_AK00442SB0121 [0,1,0,0,0,0|1,0,0]=2 101 B13R1.718 CNC(=O)CCCc1ccccc1 WXVL_AK00442SB0121 [0,1,0,0,0,0|1,0,0]=2 102 B13R1.718 CNC(=O)CCOc1ccccc1 WXVL_AK00442SB0066 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.718 CNC(=O)CCOc1ccccc1 WXVL_AK00442SB0066 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.718 CNC(=O)COCc1ccccc1 WXVL_AK00442SB0185 [0,1,0,0,0,0|2,0,0]=3 105 B13R1.718 CNC(=O)COCc1ccccc1 WXVL_AK00442SB0185 [0,1,0,0,0,0|2,0,0]=3 106 B13R1.718 O=C(CO)NCCc1ccccc1 WXVL_AK00498SB2706 [0,1,0,0,0,0|1,0,0]=2 107 B13R1.718 O=C(CO)NCCc1ccccc1 WXVL_AK00498SB2706 [0,1,0,0,0,0|1,0,0]=2 108 B13R1.718 O=C(CO)NCCc1ccccn1 WXVL_AK0019SB2706 [0,1,0,0,0,0|2,0,0]=3 109 B13R1.718 O=C(CO)NCCc1ccccn1 WXVL_AK0019SB2706 [0,1,0,0,0,0|2,0,0]=3 110 B13R1.718 O=C(CO)NCCc1cccnc1 WXVL_AK00436SB2706 [0,1,0,0,0,0|2,0,0]=3 111 B13R1.718 O=C(CO)NCCc1cccnc1 WXVL_AK00436SB2706 [0,1,0,0,0,0|2,0,0]=3 112 B13R1.718 O=C(CO)NCCc1ccncc1 WXVL_AK0093SB2706 [0,1,0,0,0,0|2,0,0]=3 113 B13R1.718 O=C(CO)NCCc1ccncc1 WXVL_AK0093SB2706 [0,1,0,0,0,0|2,0,0]=3 114 B13R1.718 O=C(CO)NCCc1ccncn1 WXVL_AK6509SB2706 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.718 O=C(CO)NCCc1ccncn1 WXVL_AK6509SB2706 [0,1,0,0,0,0|3,0,0]=4 116 B13R2.10 Cc1nc(no1)c2ccccc2 WXVL_LR0423BT0919 [0,0,0,1,0,0|2,0,1]=4 117 B13R2.10 Cc1nc(no1)c2ccccc2 WXVL_LR0423BT1115 [0,0,0,1,0,0|2,0,1]=4 118 B13R2.10 Cc1nc(no1)c2ccccc2 WXVL_LR0423BT2957 [0,0,0,1,0,0|2,0,1]=4 119 B13R2.72 NC(=O)C1CCc2c1cccc2 WXVL_AK0084SB3073 [0,0,0,1,0,0|2,0,0]=3 120 B13R2.72 NC(=O)C1CCc2c1cccc2 WXVL_AK0084SB3073 [0,0,0,1,0,0|2,0,0]=3 121 B13R2.423 NC(=O)C1CC1c2ccccc2 WXVL_AK0084SB2474 [0,0,0,1,0,0|2,0,0]=3 122 B13R2.423 NC(=O)C1CC1c2ccccc2 WXVL_AK0084SB2474 [0,0,0,1,0,0|2,0,0]=3 123 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0084SB3176 [0,0,0,1,0,0|2,0,0]=3 124 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0084SB3176 [0,0,0,1,0,0|2,0,0]=3 125 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,1,0|1,0,0]=2 126 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,1,0|1,0,0]=2 127 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,0,0,1,0|2,0,0]=3 128 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,0,0,1,0|2,0,0]=3 129 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [0,0,0,0,1,0|2,0,0]=3 130 B11R1.91 CC(=O)NCc1cccnc1 WXVL_AK0020SB0150 [0,0,0,0,1,0|2,0,0]=3 131 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [0,0,0,0,1,0|2,0,0]=3 132 B11R1.91 CC(=O)NCc1ccncc1 WXVL_AK0021SB0150 [0,0,0,0,1,0|2,0,0]=3 133 B11R1.91 CC(=O)NCc1ccncn1 WXVL_AK1356SB0150 [0,0,0,0,1,0|3,0,0]=4 134 B11R1.91 CC(=O)NCc1ccncn1 WXVL_AK1356SB0150 [0,0,0,0,1,0|3,0,0]=4 135 B11R1.91 CC(=O)NCc1cnccn1 WXVL_AK00262SB0150 [0,0,0,0,1,0|3,0,0]=4 136 B11R1.91 CC(=O)NCc1cnccn1 WXVL_AK00262SB0150 [0,0,0,0,1,0|3,0,0]=4 137 B11R1.91 CC(=O)NCc1cncnc1 WXVL_AK1364SB0150 [0,0,0,0,1,0|3,0,0]=4 138 B11R1.91 CC(=O)NCc1cncnc1 WXVL_AK1364SB0150 [0,0,0,0,1,0|3,0,0]=4 139 B11R1.91 CC(=O)NCc1ncccn1 WXVL_AK0279SB0150 [0,0,0,0,1,0|3,0,0]=4 140 B11R1.91 CC(=O)NCc1ncccn1 WXVL_AK0279SB0150 [0,0,0,0,1,0|3,0,0]=4 141 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,0,0,1,0|1,0,2]=4 142 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,0,0,1,0|1,0,2]=4 143 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [0,0,0,0,1,0|1,0,2]=4 144 B11R1.91 NC(=O)C#Cc1ccccc1 WXVL_AK0084SB0114 [0,0,0,0,1,0|1,0,2]=4 145 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [0,0,0,0,1,0|1,0,0]=2 146 B11R1.91 NC(=O)CCc1ccccc1 WXVL_AK0084SB0067 [0,0,0,0,1,0|1,0,0]=2 147 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [0,0,0,0,1,0|2,0,0]=3 148 B11R1.91 NC(=O)CCc1ccccn1 WXVL_AK0084SA0316 [0,0,0,0,1,0|2,0,0]=3 149 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [0,0,0,0,1,0|2,0,0]=3 150 B11R1.91 NC(=O)CCc1cccnc1 WXVL_AK0084SA0031 [0,0,0,0,1,0|2,0,0]=3 151 B11R1.91 NC(=O)CCc1cnccn1 WXVL_AK0084SA2354 [0,0,0,0,1,0|3,0,0]=4 152 B11R1.91 NC(=O)CCc1cnccn1 WXVL_AK0084SA2354 [0,0,0,0,1,0|3,0,0]=4 153 B11R1.91 NC(=O)CCc1cncnc1 WXVL_AK0084SA0013 [0,0,0,0,1,0|3,0,0]=4 154 B11R1.91 NC(=O)CCc1cncnc1 WXVL_AK0084SA0013 [0,0,0,0,1,0|3,0,0]=4 155 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [0,0,0,0,1,0|2,0,0]=3 156 B11R1.91 NC(=O)COc1ccccc1 WXVL_AK0084SB0086 [0,0,0,0,1,0|2,0,0]=3 157 B11R1.91 NC(=O)COc1cccnc1 WXVL_AK0084SA0051 [0,0,0,0,1,0|3,0,0]=4 158 B11R1.91 NC(=O)COc1cccnc1 WXVL_AK0084SA0051 [0,0,0,0,1,0|3,0,0]=4 159 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [0,0,0,0,1,0|2,0,0]=3 160 B11R1.91 NC(=O)CSc1ccccc1 WXVL_AK0084SB0113 [0,0,0,0,1,0|2,0,0]=3 161 B11R1.91 NC(=O)CSc1ccncc1 WXVL_AK0084SA0055 [0,0,0,0,1,0|3,0,0]=4 162 B11R1.91 NC(=O)CSc1ccncc1 WXVL_AK0084SA0055 [0,0,0,0,1,0|3,0,0]=4 163 B11R1.172 CC(=O)NCCc1cc[nH]n1 WXVL_AK1576SB0150 [0,0,0,0,1,0|3,0,0]=4 164 B11R1.172 CC(=O)NCCc1cc[nH]n1 WXVL_AK1576SB0150 [0,0,0,0,1,0|3,0,0]=4 165 B11R1.172 CC(=O)NCCc1ccco1 WXVL_AK0989SB0150 [0,0,0,0,1,0|2,0,0]=3 166 B11R1.172 CC(=O)NCCc1ccco1 WXVL_AK0989SB0150 [0,0,0,0,1,0|2,0,0]=3 167 B11R1.172 CC(=O)NCCc1cccs1 WXVL_AK0098SB0150 [0,0,0,0,1,0|2,0,0]=3 168 B11R1.172 CC(=O)NCCc1cccs1 WXVL_AK0098SB0150 [0,0,0,0,1,0|2,0,0]=3 169 B11R1.172 CC(=O)NCCc1ccsc1 WXVL_AK1342SB0150 [0,0,0,0,1,0|2,0,0]=3 170 B11R1.172 CC(=O)NCCc1ccsc1 WXVL_AK1342SB0150 [0,0,0,0,1,0|2,0,0]=3 171 B11R1.172 CC(=O)NCCc1cnc[nH]1 WXVL_AK0479SB0150 [0,0,0,0,1,0|3,0,0]=4 172 B11R1.172 CC(=O)NCCc1cnc[nH]1 WXVL_AK0479SB0150 [0,0,0,0,1,0|3,0,0]=4 173 B11R1.172 CC(=O)NCCc1ncc[nH]1 WXVL_AK00009SB0150 [0,0,0,0,1,0|3,0,0]=4 174 B11R1.172 CC(=O)NCCc1ncc[nH]1 WXVL_AK00009SB0150 [0,0,0,0,1,0|3,0,0]=4 175 B11R1.172 CC(=O)NCCc1nccs1 WXVL_AK0181SB0150 [0,0,0,0,1,0|3,0,0]=4 176 B11R1.172 CC(=O)NCCc1nccs1 WXVL_AK0181SB0150 [0,0,0,0,1,0|3,0,0]=4 177 B11R1.172 CC(=O)NCCn1cccc1 WXVL_AK1188SB0150 [0,0,0,0,1,0|2,0,0]=3 178 B11R1.172 CC(=O)NCCn1cccc1 WXVL_AK1188SB0150 [0,0,0,0,1,0|2,0,0]=3 179 B11R1.172 CC(=O)NCCn1ccnc1 WXVL_AK00034SB0150 [0,0,0,0,1,0|3,0,0]=4 180 B11R1.172 CC(=O)NCCn1ccnc1 WXVL_AK00034SB0150 [0,0,0,0,1,0|3,0,0]=4 181 B11R1.172 NC(=O)CCCn1cccc1 WXVL_AK0084SA2501 [0,0,0,0,1,0|3,0,0]=4 182 B11R1.172 NC(=O)CCCn1cccc1 WXVL_AK0084SA2501 [0,0,0,0,1,0|3,0,0]=4 183 B13R1.337 CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0150 [0,0,0,0,0,1|1,0,1]=3 184 B13R1.337 CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0150 [0,0,0,0,0,1|1,0,1]=3 185 B13R1.337 CC(=O)NCCCc1ccccc1 WXVL_AK0074SB0150 [0,0,0,0,0,1|1,0,0]=2 186 B13R1.337 CC(=O)NCCCc1ccccc1 WXVL_AK0074SB0150 [0,0,0,0,0,1|1,0,0]=2 187 B13R1.337 CC(=O)NCCCc1cccnc1 WXVL_AK2339SB0150 [0,0,0,0,0,1|2,0,0]=3 188 B13R1.337 CC(=O)NCCCc1cccnc1 WXVL_AK2339SB0150 [0,0,0,0,0,1|2,0,0]=3 189 B13R1.337 CC(=O)NCCCc1ccncc1 WXVL_AK1251SB0150 [0,0,0,0,0,1|2,0,0]=3 190 B13R1.337 CC(=O)NCCCc1ccncc1 WXVL_AK1251SB0150 [0,0,0,0,0,1|2,0,0]=3 191 B13R1.337 CC(=O)NCCNc1ccccc1 WXVL_AK2478SB0150 [0,0,0,0,0,1|1,0,0]=2 192 B13R1.337 CC(=O)NCCNc1ccccc1 WXVL_AK2478SB0150 [0,0,0,0,0,1|1,0,0]=2 193 B13R1.337 CC(=O)NCCNc1ccncn1 WXVL_AK0057LP3358 [0,0,0,0,0,1|3,0,0]=4 194 B13R1.337 CC(=O)NCCNc1ccncn1 WXVL_AK0057LP3358 [0,0,0,0,0,1|3,0,0]=4 195 B13R1.337 CC(=O)NCCNc1ncccn1 WXVL_AK0057LP0002 [0,0,0,0,0,1|3,0,0]=4 196 B13R1.337 CC(=O)NCCNc1ncccn1 WXVL_AK0057LP0002 [0,0,0,0,0,1|3,0,0]=4 197 B13R1.337 CC(=O)NCCOc1ccccc1 WXVL_AK0103SB0150 [0,0,0,0,0,1|1,0,0]=2 198 B13R1.337 CC(=O)NCCOc1ccccc1 WXVL_AK0103SB0150 [0,0,0,0,0,1|1,0,0]=2 199 B13R1.337 CC(=O)NCCOc1ccccn1 WXVL_AK2654SB0150 [0,0,0,0,0,1|2,0,0]=3 200 B13R1.337 CC(=O)NCCOc1ccccn1 WXVL_AK2654SB0150 [0,0,0,0,0,1|2,0,0]=3 201 B13R1.337 CC(=O)NCCOc1cccnc1 WXVL_AK2245SB0150 [0,0,0,0,0,1|2,0,0]=3 202 B13R1.337 CC(=O)NCCOc1cccnc1 WXVL_AK2245SB0150 [0,0,0,0,0,1|2,0,0]=3 203 B13R1.337 CC(=O)NCCOc1ccncc1 WXVL_AK00818SB0150 [0,0,0,0,0,1|2,0,0]=3 204 B13R1.337 CC(=O)NCCOc1ccncc1 WXVL_AK00818SB0150 [0,0,0,0,0,1|2,0,0]=3 205 B13R1.337 NC(=O)CCCCc1ccccc1 WXVL_AK0084SB0460 [0,0,0,0,0,1|2,0,0]=3 206 B13R1.337 NC(=O)CCCCc1ccccc1 WXVL_AK0084SB0460 [0,0,0,0,0,1|2,0,0]=3 207 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [0,1,0,0,1,0|1,0,0]=3 210 B12R1.21 CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0150 [0,1,0,0,1,0|1,0,0]=3 211 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [0,1,0,0,1,0|1,0,0]=3 212 B12R1.21 CC(=O)NCc1ccc(cc1)C WXVL_AK0048SB0150 [0,1,0,0,1,0|1,0,0]=3 213 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [0,1,0,0,1,0|1,0,0]=3 214 B12R1.21 CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0150 [0,1,0,0,1,0|1,0,0]=3 215 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [0,1,0,0,1,0|1,0,0]=3 216 B12R1.21 CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0150 [0,1,0,0,1,0|1,0,0]=3 217 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [0,1,0,0,1,0|1,0,0]=3 218 B12R1.21 CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0150 [0,1,0,0,1,0|1,0,0]=3 219 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [0,1,0,0,1,0|1,0,0]=3 220 B12R1.21 CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0150 [0,1,0,0,1,0|1,0,0]=3 221 B12R1.21 CC(=O)NCc1ccc(cn1)Br WXVL_AK00267SB0150 [0,1,0,0,1,0|2,0,0]=4 222 B12R1.21 CC(=O)NCc1ccc(cn1)Br WXVL_AK00267SB0150 [0,1,0,0,1,0|2,0,0]=4 223 B12R1.21 CC(=O)NCc1ccc(cn1)C WXVL_AK0577SB0150 [0,1,0,0,1,0|2,0,0]=4 224 B12R1.21 CC(=O)NCc1ccc(cn1)C WXVL_AK0577SB0150 [0,1,0,0,1,0|2,0,0]=4 225 B12R1.21 CC(=O)NCc1ccc(cn1)Cl WXVL_AK2138SB0150 [0,1,0,0,1,0|2,0,0]=4 226 B12R1.21 CC(=O)NCc1ccc(cn1)Cl WXVL_AK2138SB0150 [0,1,0,0,1,0|2,0,0]=4 227 B12R1.21 CC(=O)NCc1ccc(cn1)F WXVL_AK2932SB0150 [0,1,0,0,1,0|2,0,0]=4 228 B12R1.21 CC(=O)NCc1ccc(cn1)F WXVL_AK2932SB0150 [0,1,0,0,1,0|2,0,0]=4 229 B12R1.21 CC(=O)NCc1ccc(nc1)Br WXVL_AK0215SB0150 [0,1,0,0,1,0|2,0,0]=4 230 B12R1.21 CC(=O)NCc1ccc(nc1)Br WXVL_AK0215SB0150 [0,1,0,0,1,0|2,0,0]=4 231 B12R1.21 CC(=O)NCc1ccc(nc1)C WXVL_AK00257SB0150 [0,1,0,0,1,0|2,0,0]=4 232 B12R1.21 CC(=O)NCc1ccc(nc1)C WXVL_AK00257SB0150 [0,1,0,0,1,0|2,0,0]=4 233 B12R1.21 CC(=O)NCc1ccc(nc1)Cl WXVL_AK0135SB0150 [0,1,0,0,1,0|2,0,0]=4 234 B12R1.21 CC(=O)NCc1ccc(nc1)Cl WXVL_AK0135SB0150 [0,1,0,0,1,0|2,0,0]=4 235 B12R1.21 CC(=O)NCc1ccc(nc1)F WXVL_AK4307SB0150 [0,1,0,0,1,0|2,0,0]=4 236 B12R1.21 CC(=O)NCc1ccc(nc1)F WXVL_AK4307SB0150 [0,1,0,0,1,0|2,0,0]=4 237 B12R1.21 CC(=O)NCc1ccc(nc1)O WXVL_AK2049SB0150 [0,1,0,0,1,0|2,0,0]=4 238 B12R1.21 CC(=O)NCc1ccc(nc1)O WXVL_AK2049SB0150 [0,1,0,0,1,0|2,0,0]=4 239 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [0,1,0,0,1,0|1,0,0]=3 240 B12R1.21 Cc1ccc(cc1)CCC(=O)N WXVL_AK0084SB0421 [0,1,0,0,1,0|1,0,0]=3 241 B12R1.21 Cc1ccc(cc1)OCC(=O)N WXVL_AK0084SB0138 [0,1,0,0,1,0|2,0,0]=4 242 B12R1.21 Cc1ccc(cc1)OCC(=O)N WXVL_AK0084SB0138 [0,1,0,0,1,0|2,0,0]=4 243 B12R1.21 Cc1ccc(cc1)SCC(=O)N WXVL_AK0084SB0830 [0,1,0,0,1,0|2,0,0]=4 244 B12R1.21 Cc1ccc(cc1)SCC(=O)N WXVL_AK0084SB0830 [0,1,0,0,1,0|2,0,0]=4 245 B12R1.21 Cc1ccc(cn1)CCC(=O)N WXVL_AK0084SA0115 [0,1,0,0,1,0|2,0,0]=4 246 B12R1.21 Cc1ccc(cn1)CCC(=O)N WXVL_AK0084SA0115 [0,1,0,0,1,0|2,0,0]=4 247 B12R1.21 Cc1ccc(nc1)CCC(=O)N WXVL_AK0084SA0125 [0,1,0,0,1,0|2,0,0]=4 248 B12R1.21 Cc1ccc(nc1)CCC(=O)N WXVL_AK0084SA0125 [0,1,0,0,1,0|2,0,0]=4 249 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [0,1,0,0,1,0|1,0,0]=3 250 B12R1.21 NC(=O)CCc1ccc(cc1)Br WXVL_AK0084SB1166 [0,1,0,0,1,0|1,0,0]=3 251 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [0,1,0,0,1,0|1,0,0]=3 252 B12R1.21 NC(=O)CCc1ccc(cc1)F WXVL_AK0084SB1123 [0,1,0,0,1,0|1,0,0]=3 253 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [0,1,0,0,1,0|1,0,0]=3 254 B12R1.21 NC(=O)CCc1ccc(cc1)O WXVL_AK0084SB2324 [0,1,0,0,1,0|1,0,0]=3 255 B12R1.21 NC(=O)CCc1ccc(nc1)F WXVL_AK0084SA0106 [0,1,0,0,1,0|2,0,0]=4 256 B12R1.21 NC(=O)CCc1ccc(nc1)F WXVL_AK0084SA0106 [0,1,0,0,1,0|2,0,0]=4 257 B12R1.21 NC(=O)COc1ccc(cc1)F WXVL_AK0084SB0088 [0,1,0,0,1,0|2,0,0]=4 258 B12R1.21 NC(=O)COc1ccc(cc1)F WXVL_AK0084SB0088 [0,1,0,0,1,0|2,0,0]=4 259 B12R1.21 NC(=O)COc1ccc(cc1)O WXVL_AK0084SB3388 [0,1,0,0,1,0|2,0,0]=4 260 B12R1.21 NC(=O)COc1ccc(cc1)O WXVL_AK0084SB3388 [0,1,0,0,1,0|2,0,0]=4 261 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [0,1,0,0,1,0|1,0,1]=4 262 B12R1.43 C=C(Cc1ccccc1)C(=O)N WXVL_AK0084SB0413 [0,1,0,0,1,0|1,0,1]=4 263 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,1,0|1,0,1]=4 264 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,1,0|1,0,1]=4 265 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [0,1,0,0,1,0|1,0,0]=3 266 B12R1.43 CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0150 [0,1,0,0,1,0|1,0,0]=3 267 B12R1.43 CC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0150 [0,1,0,0,1,0|2,0,0]=4 268 B12R1.43 CC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0150 [0,1,0,0,1,0|2,0,0]=4 269 B12R1.43 CC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0150 [0,1,0,0,1,0|2,0,0]=4 270 B12R1.43 CC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0150 [0,1,0,0,1,0|2,0,0]=4 271 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [0,1,0,0,1,0|1,0,0]=3 272 B12R1.43 CC(Cc1ccccc1)C(=O)N WXVL_AK0084SB3205 [0,1,0,0,1,0|1,0,0]=3 273 B12R1.43 CC(Cc1ccccn1)C(=O)N WXVL_AK0084SA0686 [0,1,0,0,1,0|2,0,0]=4 274 B12R1.43 CC(Cc1ccccn1)C(=O)N WXVL_AK0084SA0686 [0,1,0,0,1,0|2,0,0]=4 275 B12R1.43 CC(Oc1ccccc1)C(=O)N WXVL_AK0084SB0426 [0,1,0,0,1,0|2,0,0]=4 276 B12R1.43 CC(Oc1ccccc1)C(=O)N WXVL_AK0084SB0426 [0,1,0,0,1,0|2,0,0]=4 277 B12R1.43 CC(Sc1ccccc1)C(=O)N WXVL_AK0084SB9992 [0,1,0,0,1,0|2,0,0]=4 278 B12R1.43 CC(Sc1ccccc1)C(=O)N WXVL_AK0084SB9992 [0,1,0,0,1,0|2,0,0]=4 279 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)N WXVL_AK0084SB5803 [0,1,0,0,1,0|2,0,0]=4 280 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)N WXVL_AK0084SB5803 [0,1,0,0,1,0|2,0,0]=4 281 B12R1.107 CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0150 [0,1,0,0,1,0|2,0,0]=4 282 B12R1.107 CC(=O)NC(C)c1ccccn1 WXVL_AK0585SB0150 [0,1,0,0,1,0|2,0,0]=4 283 B12R1.107 CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0150 [0,1,0,0,1,0|2,0,0]=4 284 B12R1.107 CC(=O)NC(C)c1ccncc1 WXVL_AK0282SB0150 [0,1,0,0,1,0|2,0,0]=4 285 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0150 [0,1,0,0,1,0|2,0,0]=4 286 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 WXVL_AK00388SB0150 [0,1,0,0,1,0|2,0,0]=4 287 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0150 [0,1,0,0,1,0|2,0,0]=4 288 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 WXVL_AK3888SB0150 [0,1,0,0,1,0|2,0,0]=4 289 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0150 [0,1,0,0,1,0|2,0,0]=4 290 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 WXVL_AK1519SB0150 [0,1,0,0,1,0|2,0,0]=4 291 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0150 [0,1,0,0,1,0|2,0,0]=4 292 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 WXVL_AK00154SB0150 [0,1,0,0,1,0|2,0,0]=4 293 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,1,0,0,1,0|1,0,0]=3 294 B12R1.107 CC(CC(=O)N)c1ccccc1 WXVL_AK0084SB0419 [0,1,0,0,1,0|1,0,0]=3 295 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,1,0,0,1,0|1,0,0]=3 296 B12R1.107 NC(=O)CC(O)c1ccccc1 WXVL_AK0084SB2325 [0,1,0,0,1,0|1,0,0]=3 297 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [0,1,0,0,1,0|1,0,0]=3 298 B12R1.125 CC(=O)NCc1ccccc1Br WXVL_AK1632SB0150 [0,1,0,0,1,0|1,0,0]=3 299 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [0,1,0,0,1,0|1,0,0]=3 300 B12R1.125 CC(=O)NCc1ccccc1C WXVL_AK0040SB0150 [0,1,0,0,1,0|1,0,0]=3 301 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [0,1,0,0,1,0|1,0,0]=3 302 B12R1.125 CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0150 [0,1,0,0,1,0|1,0,0]=3 303 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [0,1,0,0,1,0|1,0,0]=3 304 B12R1.125 CC(=O)NCc1ccccc1F WXVL_AK0037SB0150 [0,1,0,0,1,0|1,0,0]=3 305 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [0,1,0,0,1,0|1,0,0]=3 306 B12R1.125 CC(=O)NCc1ccccc1I WXVL_AK3923SB0150 [0,1,0,0,1,0|1,0,0]=3 307 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [0,1,0,0,1,0|1,0,0]=3 308 B12R1.125 CC(=O)NCc1ccccc1O WXVL_AK0963SB0150 [0,1,0,0,1,0|1,0,0]=3 309 B12R1.125 CC(=O)NCc1cccnc1Br WXVL_AK4357SB0150 [0,1,0,0,1,0|2,0,0]=4 310 B12R1.125 CC(=O)NCc1cccnc1Br WXVL_AK4357SB0150 [0,1,0,0,1,0|2,0,0]=4 311 B12R1.125 CC(=O)NCc1cccnc1C WXVL_AK00258SB0150 [0,1,0,0,1,0|2,0,0]=4 312 B12R1.125 CC(=O)NCc1cccnc1C WXVL_AK00258SB0150 [0,1,0,0,1,0|2,0,0]=4 313 B12R1.125 CC(=O)NCc1cccnc1F WXVL_AK00552SB0150 [0,1,0,0,1,0|2,0,0]=4 314 B12R1.125 CC(=O)NCc1cccnc1F WXVL_AK00552SB0150 [0,1,0,0,1,0|2,0,0]=4 315 B12R1.125 CC(=O)NCc1ccncc1Cl WXVL_AK3976SB0150 [0,1,0,0,1,0|2,0,0]=4 316 B12R1.125 CC(=O)NCc1ccncc1Cl WXVL_AK3976SB0150 [0,1,0,0,1,0|2,0,0]=4 317 B12R1.125 CC(=O)NCc1ccncc1F WXVL_AK1489SB0150 [0,1,0,0,1,0|2,0,0]=4 318 B12R1.125 CC(=O)NCc1ccncc1F WXVL_AK1489SB0150 [0,1,0,0,1,0|2,0,0]=4 319 B12R1.125 CC(=O)NCc1cnccc1C WXVL_AK1230SB0150 [0,1,0,0,1,0|2,0,0]=4 320 B12R1.125 CC(=O)NCc1cnccc1C WXVL_AK1230SB0150 [0,1,0,0,1,0|2,0,0]=4 321 B12R1.125 CC(=O)NCc1cnccc1Cl WXVL_AK0322SB0150 [0,1,0,0,1,0|2,0,0]=4 322 B12R1.125 CC(=O)NCc1cnccc1Cl WXVL_AK0322SB0150 [0,1,0,0,1,0|2,0,0]=4 323 B12R1.125 CC(=O)NCc1ncccc1C WXVL_AK0162SB0150 [0,1,0,0,1,0|2,0,0]=4 324 B12R1.125 CC(=O)NCc1ncccc1C WXVL_AK0162SB0150 [0,1,0,0,1,0|2,0,0]=4 325 B12R1.125 CC(=O)NCc1ncccc1F WXVL_AK00098SB0150 [0,1,0,0,1,0|2,0,0]=4 326 B12R1.125 CC(=O)NCc1ncccc1F WXVL_AK00098SB0150 [0,1,0,0,1,0|2,0,0]=4 327 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [0,1,0,0,1,0|1,0,0]=3 328 B12R1.125 Cc1ccccc1CCC(=O)N WXVL_AK0084SB0422 [0,1,0,0,1,0|1,0,0]=3 329 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [0,1,0,0,1,0|2,0,0]=4 330 B12R1.125 Cc1ccccc1OCC(=O)N WXVL_AK0084SB0136 [0,1,0,0,1,0|2,0,0]=4 331 B12R1.125 Cc1cccnc1CCC(=O)N WXVL_AK0084SA0096 [0,1,0,0,1,0|2,0,0]=4 332 B12R1.125 Cc1cccnc1CCC(=O)N WXVL_AK0084SA0096 [0,1,0,0,1,0|2,0,0]=4 333 B12R1.125 Cc1ncccc1CCC(=O)N WXVL_AK0084SA0046 [0,1,0,0,1,0|2,0,0]=4 334 B12R1.125 Cc1ncccc1CCC(=O)N WXVL_AK0084SA0046 [0,1,0,0,1,0|2,0,0]=4 335 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [0,1,0,0,1,0|1,0,0]=3 336 B12R1.125 NC(=O)CCc1ccccc1Br WXVL_AK0084SB1278 [0,1,0,0,1,0|1,0,0]=3 337 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [0,1,0,0,1,0|1,0,0]=3 338 B12R1.125 NC(=O)CCc1ccccc1Cl WXVL_AK0084SB0140 [0,1,0,0,1,0|1,0,0]=3 339 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [0,1,0,0,1,0|1,0,0]=3 340 B12R1.125 NC(=O)CCc1ccccc1F WXVL_AK0084SB0008 [0,1,0,0,1,0|1,0,0]=3 341 B12R1.125 NC(=O)COc1ccccc1F WXVL_AK0084SB0441 [0,1,0,0,1,0|2,0,0]=4 342 B12R1.125 NC(=O)COc1ccccc1F WXVL_AK0084SB0441 [0,1,0,0,1,0|2,0,0]=4 343 B12R1.226 CC(=O)NCc1cc(ccn1)Br WXVL_AK1470SB0150 [0,1,0,0,1,0|2,0,0]=4 344 B12R1.226 CC(=O)NCc1cc(ccn1)Br WXVL_AK1470SB0150 [0,1,0,0,1,0|2,0,0]=4 345 B12R1.226 CC(=O)NCc1cc(ccn1)C WXVL_AK00280SB0150 [0,1,0,0,1,0|2,0,0]=4 346 B12R1.226 CC(=O)NCc1cc(ccn1)C WXVL_AK00280SB0150 [0,1,0,0,1,0|2,0,0]=4 347 B12R1.226 CC(=O)NCc1cc(ccn1)Cl WXVL_AK0280SB0150 [0,1,0,0,1,0|2,0,0]=4 348 B12R1.226 CC(=O)NCc1cc(ccn1)Cl WXVL_AK0280SB0150 [0,1,0,0,1,0|2,0,0]=4 349 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [0,1,0,0,1,0|1,0,0]=3 350 B12R1.226 CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0150 [0,1,0,0,1,0|1,0,0]=3 351 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [0,1,0,0,1,0|1,0,0]=3 352 B12R1.226 CC(=O)NCc1cccc(c1)C WXVL_AK0045SB0150 [0,1,0,0,1,0|1,0,0]=3 353 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [0,1,0,0,1,0|1,0,0]=3 354 B12R1.226 CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0150 [0,1,0,0,1,0|1,0,0]=3 355 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [0,1,0,0,1,0|1,0,0]=3 356 B12R1.226 CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0150 [0,1,0,0,1,0|1,0,0]=3 357 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [0,1,0,0,1,0|1,0,0]=3 358 B12R1.226 CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0150 [0,1,0,0,1,0|1,0,0]=3 359 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [0,1,0,0,1,0|1,0,0]=3 360 B12R1.226 CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0150 [0,1,0,0,1,0|1,0,0]=3 361 B12R1.226 CC(=O)NCc1cccc(n1)Br WXVL_AK2161SB0150 [0,1,0,0,1,0|2,0,0]=4 362 B12R1.226 CC(=O)NCc1cccc(n1)Br WXVL_AK2161SB0150 [0,1,0,0,1,0|2,0,0]=4 363 B12R1.226 CC(=O)NCc1cccc(n1)C WXVL_AK0164SB0150 [0,1,0,0,1,0|2,0,0]=4 364 B12R1.226 CC(=O)NCc1cccc(n1)C WXVL_AK0164SB0150 [0,1,0,0,1,0|2,0,0]=4 365 B12R1.226 CC(=O)NCc1cccc(n1)F WXVL_AK1928SB0150 [0,1,0,0,1,0|2,0,0]=4 366 B12R1.226 CC(=O)NCc1cccc(n1)F WXVL_AK1928SB0150 [0,1,0,0,1,0|2,0,0]=4 367 B12R1.226 CC(=O)NCc1ccnc(c1)Br WXVL_AK2247SB0150 [0,1,0,0,1,0|2,0,0]=4 368 B12R1.226 CC(=O)NCc1ccnc(c1)Br WXVL_AK2247SB0150 [0,1,0,0,1,0|2,0,0]=4 369 B12R1.226 CC(=O)NCc1ccnc(c1)C WXVL_AK0517SB0150 [0,1,0,0,1,0|2,0,0]=4 370 B12R1.226 CC(=O)NCc1ccnc(c1)C WXVL_AK0517SB0150 [0,1,0,0,1,0|2,0,0]=4 371 B12R1.226 CC(=O)NCc1ccnc(c1)Cl WXVL_AK0323SB0150 [0,1,0,0,1,0|2,0,0]=4 372 B12R1.226 CC(=O)NCc1ccnc(c1)Cl WXVL_AK0323SB0150 [0,1,0,0,1,0|2,0,0]=4 373 B12R1.226 CC(=O)NCc1ccnc(c1)F WXVL_AK00762SB0150 [0,1,0,0,1,0|2,0,0]=4 374 B12R1.226 CC(=O)NCc1ccnc(c1)F WXVL_AK00762SB0150 [0,1,0,0,1,0|2,0,0]=4 375 B12R1.226 CC(=O)NCc1cncc(c1)Br WXVL_AK2589SB0150 [0,1,0,0,1,0|2,0,0]=4 376 B12R1.226 CC(=O)NCc1cncc(c1)Br WXVL_AK2589SB0150 [0,1,0,0,1,0|2,0,0]=4 377 B12R1.226 CC(=O)NCc1cncc(c1)C WXVL_AK00253SB0150 [0,1,0,0,1,0|2,0,0]=4 378 B12R1.226 CC(=O)NCc1cncc(c1)C WXVL_AK00253SB0150 [0,1,0,0,1,0|2,0,0]=4 379 B12R1.226 CC(=O)NCc1cncc(c1)Cl WXVL_AK3939SB0150 [0,1,0,0,1,0|2,0,0]=4 380 B12R1.226 CC(=O)NCc1cncc(c1)Cl WXVL_AK3939SB0150 [0,1,0,0,1,0|2,0,0]=4 381 B12R1.226 CC(=O)NCc1cncc(c1)F WXVL_AK1430SB0150 [0,1,0,0,1,0|2,0,0]=4 382 B12R1.226 CC(=O)NCc1cncc(c1)F WXVL_AK1430SB0150 [0,1,0,0,1,0|2,0,0]=4 383 B12R1.226 Cc1cc(ccn1)CCC(=O)N WXVL_AK0084SA0045 [0,1,0,0,1,0|2,0,0]=4 384 B12R1.226 Cc1cc(ccn1)CCC(=O)N WXVL_AK0084SA0045 [0,1,0,0,1,0|2,0,0]=4 385 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [0,1,0,0,1,0|1,0,0]=3 386 B12R1.226 Cc1cccc(c1)CCC(=O)N WXVL_AK0084SB1394 [0,1,0,0,1,0|1,0,0]=3 387 B12R1.226 Cc1cccc(n1)CCC(=O)N WXVL_AK0084SA0044 [0,1,0,0,1,0|2,0,0]=4 388 B12R1.226 Cc1cccc(n1)CCC(=O)N WXVL_AK0084SA0044 [0,1,0,0,1,0|2,0,0]=4 389 B12R1.226 NC(=O)CCc1cc(ccn1)F WXVL_AK0084SA0107 [0,1,0,0,1,0|2,0,0]=4 390 B12R1.226 NC(=O)CCc1cc(ccn1)F WXVL_AK0084SA0107 [0,1,0,0,1,0|2,0,0]=4 391 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [0,1,0,0,1,0|1,0,0]=3 392 B12R1.226 NC(=O)CCc1cccc(c1)Br WXVL_AK0084SB0278 [0,1,0,0,1,0|1,0,0]=3 393 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [0,1,0,0,1,0|1,0,0]=3 394 B12R1.226 NC(=O)CCc1cccc(c1)O WXVL_AK0084SB3088 [0,1,0,0,1,0|1,0,0]=3 395 B12R1.226 NC(=O)COc1cccc(c1)Cl WXVL_AK0084SB0493 [0,1,0,0,1,0|2,0,0]=4 396 B12R1.226 NC(=O)COc1cccc(c1)Cl WXVL_AK0084SB0493 [0,1,0,0,1,0|2,0,0]=4 397 B12R1.891 NS(=O)(=O)CCc1ccccc1 WXVL_AK0084HU0137 [0,1,0,0,1,0|2,0,0]=4 398 B12R1.891 NS(=O)(=O)CCc1ccccc1 WXVL_AK0084HU0137 [0,1,0,0,1,0|2,0,0]=4 399 B12R1.105 CC(=O)NCCc1ccc(s1)Br WXVL_AK5921SB0150 [0,1,0,0,1,0|2,0,0]=4 400 B12R1.105 CC(=O)NCCc1ccc(s1)Br WXVL_AK5921SB0150 [0,1,0,0,1,0|2,0,0]=4 401 B12R1.477 CCC(=O)NCCc1ccco1 WXVL_AK0989SB0064 [0,1,0,0,1,0|2,0,0]=4 402 B12R1.477 CCC(=O)NCCc1ccco1 WXVL_AK0989SB0064 [0,1,0,0,1,0|2,0,0]=4 403 B12R1.477 CCC(=O)NCCc1cccs1 WXVL_AK0098SB0064 [0,1,0,0,1,0|2,0,0]=4 404 B12R1.477 CCC(=O)NCCc1cccs1 WXVL_AK0098SB0064 [0,1,0,0,1,0|2,0,0]=4 405 B12R1.477 CCC(=O)NCCc1ccsc1 WXVL_AK1342SB0064 [0,1,0,0,1,0|2,0,0]=4 406 B12R1.477 CCC(=O)NCCc1ccsc1 WXVL_AK1342SB0064 [0,1,0,0,1,0|2,0,0]=4 407 B12R1.477 CCC(=O)NCCn1cccc1 WXVL_AK1188SB0064 [0,1,0,0,1,0|2,0,0]=4 408 B12R1.477 CCC(=O)NCCn1cccc1 WXVL_AK1188SB0064 [0,1,0,0,1,0|2,0,0]=4 409 B12R1.477 CNC(=O)CCCn1cccc1 WXVL_AK00442SA2501 [0,1,0,0,1,0|2,0,0]=4 410 B12R1.477 CNC(=O)CCCn1cccc1 WXVL_AK00442SA2501 [0,1,0,0,1,0|2,0,0]=4 411 B12R1.477 O=C(CO)NCCc1ccco1 WXVL_AK0989SB2706 [0,1,0,0,1,0|2,0,0]=4 412 B12R1.477 O=C(CO)NCCc1ccco1 WXVL_AK0989SB2706 [0,1,0,0,1,0|2,0,0]=4 413 B12R1.477 O=C(CO)NCCc1cccs1 WXVL_AK0098SB2706 [0,1,0,0,1,0|2,0,0]=4 414 B12R1.477 O=C(CO)NCCc1cccs1 WXVL_AK0098SB2706 [0,1,0,0,1,0|2,0,0]=4 415 B12R1.477 O=C(CO)NCCc1ccsc1 WXVL_AK1342SB2706 [0,1,0,0,1,0|2,0,0]=4 416 B12R1.477 O=C(CO)NCCc1ccsc1 WXVL_AK1342SB2706 [0,1,0,0,1,0|2,0,0]=4 417 B12R1.477 O=C(CO)NCCn1cccc1 WXVL_AK1188SB2706 [0,1,0,0,1,0|2,0,0]=4 418 B12R1.477 O=C(CO)NCCn1cccc1 WXVL_AK1188SB2706 [0,1,0,0,1,0|2,0,0]=4 419 B14R1.148 CC(=O)NCCOc1cccc(c1)Br WXVL_AK0441SB0150 [0,1,0,0,0,1|1,0,0]=3 420 B14R1.148 CC(=O)NCCOc1cccc(c1)Br WXVL_AK0441SB0150 [0,1,0,0,0,1|1,0,0]=3 421 B14R1.148 CC(=O)NCCOc1cccc(c1)F WXVL_AK2572SB0150 [0,1,0,0,0,1|1,0,0]=3 422 B14R1.148 CC(=O)NCCOc1cccc(c1)F WXVL_AK2572SB0150 [0,1,0,0,0,1|1,0,0]=3 423 B14R1.148 NC(=O)CCCOc1cccc(c1)Br WXVL_AK0084SBB366 [0,1,0,0,0,1|2,0,0]=4 424 B14R1.148 NC(=O)CCCOc1cccc(c1)Br WXVL_AK0084SBB366 [0,1,0,0,0,1|2,0,0]=4 425 B14R1.159 CC(=O)NCCOc1ccccc1C WXVL_AK1111SB0150 [0,1,0,0,0,1|1,0,0]=3 426 B14R1.159 CC(=O)NCCOc1ccccc1C WXVL_AK1111SB0150 [0,1,0,0,0,1|1,0,0]=3 427 B14R1.159 CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB0150 [0,1,0,0,0,1|1,0,0]=3 428 B14R1.159 CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB0150 [0,1,0,0,0,1|1,0,0]=3 429 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [0,1,0,0,0,1|1,0,0]=3 430 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [0,1,0,0,0,1|1,0,0]=3 431 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [0,1,0,0,0,1|1,0,1]=4 432 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [0,1,0,0,0,1|1,0,1]=4 433 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AG00183SB0357 [0,1,0,0,0,1|1,0,1]=4 434 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AG00183SB0357 [0,1,0,0,0,1|1,0,1]=4 435 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AK2641SB0150 [0,1,0,0,0,1|1,0,1]=4 436 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AK2641SB0150 [0,1,0,0,0,1|1,0,1]=4 437 B14R1.423 CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB0150 [0,1,0,0,0,1|1,0,0]=3 438 B14R1.423 CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB0150 [0,1,0,0,0,1|1,0,0]=3 439 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,1,0,0,0,1|0,0,1]=3 440 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,1,0,0,0,1|0,0,1]=3 441 B14R1.423 CC(=O)OCC(=O)Nc1ccccn1 WXVL_AF00298SB2824 [0,1,0,0,0,1|1,0,1]=4 442 B14R1.423 CC(=O)OCC(=O)Nc1ccccn1 WXVL_AF00298SB2824 [0,1,0,0,0,1|1,0,1]=4 443 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 WXVL_AG00183SB3992 [0,1,0,0,0,1|0,1,1]=4 444 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 WXVL_AG00183SB3992 [0,1,0,0,0,1|0,1,1]=4 445 B14R1.677 CC(=O)NCCOc1ccc(cc1)C WXVL_AK7560SB0150 [0,1,0,0,0,1|1,0,0]=3 446 B14R1.677 CC(=O)NCCOc1ccc(cc1)C WXVL_AK7560SB0150 [0,1,0,0,0,1|1,0,0]=3 447 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl WXVL_AK0501SB0150 [0,1,0,0,0,1|1,0,0]=3 448 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl WXVL_AK0501SB0150 [0,1,0,0,0,1|1,0,0]=3 449 B14R1.677 CC(=O)NCCOc1ccc(cc1)F WXVL_AK0979SB0150 [0,1,0,0,0,1|1,0,0]=3 450 B14R1.677 CC(=O)NCCOc1ccc(cc1)F WXVL_AK0979SB0150 [0,1,0,0,0,1|1,0,0]=3 451 B14R1.677 Cc1ccc(cc1)CSCCC(=O)N WXVL_AK0084SB7299 [0,1,0,0,0,1|2,0,0]=4 452 B14R1.677 Cc1ccc(cc1)CSCCC(=O)N WXVL_AK0084SB7299 [0,1,0,0,0,1|2,0,0]=4 453 B14R1.677 NC(=O)CCCOc1ccc(cc1)Br WXVL_AK0084SB4620 [0,1,0,0,0,1|2,0,0]=4 454 B14R1.677 NC(=O)CCCOc1ccc(cc1)Br WXVL_AK0084SB4620 [0,1,0,0,0,1|2,0,0]=4 455 B14R1.677 NC(=O)CCCOc1ccc(cc1)Cl WXVL_AK0084SB1563 [0,1,0,0,0,1|2,0,0]=4 456 B14R1.677 NC(=O)CCCOc1ccc(cc1)Cl WXVL_AK0084SB1563 [0,1,0,0,0,1|2,0,0]=4 457 B14R1.716 C#CC(=O)NCCCc1ccccc1 WXVL_AK0074SB0338 [0,1,0,0,0,1|1,0,1]=4 458 B14R1.716 C#CC(=O)NCCCc1ccccc1 WXVL_AK0074SB0338 [0,1,0,0,0,1|1,0,1]=4 459 B14R1.716 C#CC(=O)NCCNc1ccccc1 WXVL_AK2478SB0338 [0,1,0,0,0,1|1,0,1]=4 460 B14R1.716 C#CC(=O)NCCNc1ccccc1 WXVL_AK2478SB0338 [0,1,0,0,0,1|1,0,1]=4 461 B14R1.716 C#CC(=O)NCCOc1ccccc1 WXVL_AK0103SB0338 [0,1,0,0,0,1|1,0,1]=4 462 B14R1.716 C#CC(=O)NCCOc1ccccc1 WXVL_AK0103SB0338 [0,1,0,0,0,1|1,0,1]=4 463 B14R1.716 CCC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0064 [0,1,0,0,0,1|1,0,1]=4 464 B14R1.716 CCC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0064 [0,1,0,0,0,1|1,0,1]=4 465 B14R1.716 CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0064 [0,1,0,0,0,1|1,0,0]=3 466 B14R1.716 CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0064 [0,1,0,0,0,1|1,0,0]=3 467 B14R1.716 CCC(=O)NCCCc1cccnc1 WXVL_AK2339SB0064 [0,1,0,0,0,1|2,0,0]=4 468 B14R1.716 CCC(=O)NCCCc1cccnc1 WXVL_AK2339SB0064 [0,1,0,0,0,1|2,0,0]=4 469 B14R1.716 CCC(=O)NCCCc1ccncc1 WXVL_AK1251SB0064 [0,1,0,0,0,1|2,0,0]=4 470 B14R1.716 CCC(=O)NCCCc1ccncc1 WXVL_AK1251SB0064 [0,1,0,0,0,1|2,0,0]=4 471 B14R1.716 CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0064 [0,1,0,0,0,1|1,0,0]=3 472 B14R1.716 CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0064 [0,1,0,0,0,1|1,0,0]=3 473 B14R1.716 CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0064 [0,1,0,0,0,1|1,0,0]=3 474 B14R1.716 CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0064 [0,1,0,0,0,1|1,0,0]=3 475 B14R1.716 CCC(=O)NCCOc1ccccn1 WXVL_AK2654SB0064 [0,1,0,0,0,1|2,0,0]=4 476 B14R1.716 CCC(=O)NCCOc1ccccn1 WXVL_AK2654SB0064 [0,1,0,0,0,1|2,0,0]=4 477 B14R1.716 CCC(=O)NCCOc1cccnc1 WXVL_AK2245SB0064 [0,1,0,0,0,1|2,0,0]=4 478 B14R1.716 CCC(=O)NCCOc1cccnc1 WXVL_AK2245SB0064 [0,1,0,0,0,1|2,0,0]=4 479 B14R1.716 CCC(=O)NCCOc1ccncc1 WXVL_AK00818SB0064 [0,1,0,0,0,1|2,0,0]=4 480 B14R1.716 CCC(=O)NCCOc1ccncc1 WXVL_AK00818SB0064 [0,1,0,0,0,1|2,0,0]=4 481 B14R1.716 CNC(=O)CCCCc1ccccc1 WXVL_AK00442SB0460 [0,1,0,0,0,1|1,0,0]=3 482 B14R1.716 CNC(=O)CCCCc1ccccc1 WXVL_AK00442SB0460 [0,1,0,0,0,1|1,0,0]=3 483 B14R1.716 O=C(CO)NC/C=C/c1ccccc1 WXVL_AK00073SB2706 [0,1,0,0,0,1|1,0,1]=4 484 B14R1.716 O=C(CO)NC/C=C/c1ccccc1 WXVL_AK00073SB2706 [0,1,0,0,0,1|1,0,1]=4 485 B14R1.716 O=C(CO)NCCCc1ccccc1 WXVL_AK0074SB2706 [0,1,0,0,0,1|1,0,0]=3 486 B14R1.716 O=C(CO)NCCCc1ccccc1 WXVL_AK0074SB2706 [0,1,0,0,0,1|1,0,0]=3 487 B14R1.716 O=C(CO)NCCCc1cccnc1 WXVL_AK2339SB2706 [0,1,0,0,0,1|2,0,0]=4 488 B14R1.716 O=C(CO)NCCCc1cccnc1 WXVL_AK2339SB2706 [0,1,0,0,0,1|2,0,0]=4 489 B14R1.716 O=C(CO)NCCCc1ccncc1 WXVL_AK1251SB2706 [0,1,0,0,0,1|2,0,0]=4 490 B14R1.716 O=C(CO)NCCCc1ccncc1 WXVL_AK1251SB2706 [0,1,0,0,0,1|2,0,0]=4 491 B14R1.716 O=C(CO)NCCNc1ccccc1 WXVL_AK2478SB2706 [0,1,0,0,0,1|1,0,0]=3 492 B14R1.716 O=C(CO)NCCNc1ccccc1 WXVL_AK2478SB2706 [0,1,0,0,0,1|1,0,0]=3 493 B14R1.716 O=C(CO)NCCOc1ccccc1 WXVL_AK0103SB2706 [0,1,0,0,0,1|1,0,0]=3 494 B14R1.716 O=C(CO)NCCOc1ccccc1 WXVL_AK0103SB2706 [0,1,0,0,0,1|1,0,0]=3 495 B14R1.716 O=C(CO)NCCOc1ccccn1 WXVL_AK2654SB2706 [0,1,0,0,0,1|2,0,0]=4 496 B14R1.716 O=C(CO)NCCOc1ccccn1 WXVL_AK2654SB2706 [0,1,0,0,0,1|2,0,0]=4 497 B14R1.716 O=C(CO)NCCOc1cccnc1 WXVL_AK2245SB2706 [0,1,0,0,0,1|2,0,0]=4 498 B14R1.716 O=C(CO)NCCOc1cccnc1 WXVL_AK2245SB2706 [0,1,0,0,0,1|2,0,0]=4 499 B14R1.716 O=C(CO)NCCOc1ccncc1 WXVL_AK00818SB2706 [0,1,0,0,0,1|2,0,0]=4 500 B14R1.716 O=C(CO)NCCOc1ccncc1 WXVL_AK00818SB2706 [0,1,0,0,0,1|2,0,0]=4 501 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0051 [0,1,0,0,0,1|1,0,0]=3 502 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0051 [0,1,0,0,0,1|1,0,0]=3 503 B14R1.6449 CC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0051 [0,1,0,0,0,1|2,0,0]=4 504 B14R1.6449 CC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0051 [0,1,0,0,0,1|2,0,0]=4 505 B14R1.6449 CC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0051 [0,1,0,0,0,1|2,0,0]=4 506 B14R1.6449 CC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0051 [0,1,0,0,0,1|2,0,0]=4 507 B14R1.6449 CC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0051 [0,1,0,0,0,1|2,0,0]=4 508 B14R1.6449 CC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0051 [0,1,0,0,0,1|2,0,0]=4 509 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 WXVL_AN2288SB0150 [0,1,0,0,0,1|1,0,0]=3 510 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 WXVL_AN2288SB0150 [0,1,0,0,0,1|1,0,0]=3 511 B14R1.6449 NC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0128 [0,1,0,0,0,1|2,0,0]=4 512 B14R1.6449 NC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0128 [0,1,0,0,0,1|2,0,0]=4 513 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB0150 [0,2,0,0,0,0|1,0,0]=3 514 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB0150 [0,2,0,0,0,0|1,0,0]=3 515 B14R1.163 C#CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0338 [0,2,0,0,0,0|1,0,1]=4 516 B14R1.163 C#CC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0338 [0,2,0,0,0,0|1,0,1]=4 517 B14R1.163 C#CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0338 [0,2,0,0,0,0|1,0,1]=4 518 B14R1.163 C#CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0338 [0,2,0,0,0,0|1,0,1]=4 519 B14R1.163 C#CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0338 [0,2,0,0,0,0|1,0,1]=4 520 B14R1.163 C#CC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0338 [0,2,0,0,0,0|1,0,1]=4 521 B14R1.163 CC(CNC(=O)CO)c1ccccc1 WXVL_AK00546SB2706 [0,2,0,0,0,0|1,0,0]=3 522 B14R1.163 CC(CNC(=O)CO)c1ccccc1 WXVL_AK00546SB2706 [0,2,0,0,0,0|1,0,0]=3 523 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [0,2,0,0,0,0|1,0,0]=3 524 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [0,2,0,0,0,0|1,0,0]=3 525 B14R1.163 CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0064 [0,2,0,0,0,0|1,0,0]=3 526 B14R1.163 CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0064 [0,2,0,0,0,0|1,0,0]=3 527 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [0,2,0,0,0,0|1,0,0]=3 528 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [0,2,0,0,0,0|1,0,0]=3 529 B14R1.163 C[C@H](CNC(=O)CO)c1ccccc1 WXVL_AK00506SB2706 [0,2,0,0,0,0|1,0,0]=3 530 B14R1.163 C[C@H](CNC(=O)CO)c1ccccc1 WXVL_AK00506SB2706 [0,2,0,0,0,0|1,0,0]=3 531 B14R1.163 O=C(CO)NCC(O)c1ccccc1 WXVL_AK0051SB2706 [0,2,0,0,0,0|1,0,0]=3 532 B14R1.163 O=C(CO)NCC(O)c1ccccc1 WXVL_AK0051SB2706 [0,2,0,0,0,0|1,0,0]=3 533 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 WXVL_AN3044SB0150 [0,2,0,0,0,0|1,0,0]=3 534 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 WXVL_AN3044SB0150 [0,2,0,0,0,0|1,0,0]=3 535 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB0150 [0,2,0,0,0,0|1,0,0]=3 536 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB0150 [0,2,0,0,0,0|1,0,0]=3 537 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 WXVL_AK0159SB0150 [0,2,0,0,0,0|1,0,0]=3 538 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 WXVL_AK0159SB0150 [0,2,0,0,0,0|1,0,0]=3 539 B14R1.76 COc1cccc(c1)CCNC(=O)C WXVL_AK0065SB0150 [0,2,0,0,0,0|1,0,0]=3 540 B14R1.76 COc1cccc(c1)CCNC(=O)C WXVL_AK0065SB0150 [0,2,0,0,0,0|1,0,0]=3 541 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C WXVL_AK0924SB0150 [0,2,0,0,0,0|1,0,0]=3 542 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C WXVL_AK0924SB0150 [0,2,0,0,0,0|1,0,0]=3 543 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl WXVL_AK0874SB0150 [0,2,0,0,0,0|1,0,0]=3 544 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl WXVL_AK0874SB0150 [0,2,0,0,0,0|1,0,0]=3 545 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O WXVL_AK00493SB0150 [0,2,0,0,0,0|1,0,0]=3 546 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O WXVL_AK00493SB0150 [0,2,0,0,0,0|1,0,0]=3 547 B14R1.1025 C#CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0338 [0,2,0,0,0,0|1,0,1]=4 548 B14R1.1025 C#CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0338 [0,2,0,0,0,0|1,0,1]=4 549 B14R1.1025 C#CC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0338 [0,2,0,0,0,0|1,0,1]=4 550 B14R1.1025 C#CC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0338 [0,2,0,0,0,0|1,0,1]=4 551 B14R1.1025 C#CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0338 [0,2,0,0,0,0|1,0,1]=4 552 B14R1.1025 C#CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0338 [0,2,0,0,0,0|1,0,1]=4 553 B14R1.1025 C#CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0338 [0,2,0,0,0,0|1,0,1]=4 554 B14R1.1025 C#CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0338 [0,2,0,0,0,0|1,0,1]=4 555 B14R1.1025 C#CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0338 [0,2,0,0,0,0|1,0,1]=4 556 B14R1.1025 C#CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0338 [0,2,0,0,0,0|1,0,1]=4 557 B14R1.1025 CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0064 [0,2,0,0,0,0|1,0,0]=3 558 B14R1.1025 CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0064 [0,2,0,0,0,0|1,0,0]=3 559 B14R1.1025 CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0064 [0,2,0,0,0,0|1,0,0]=3 560 B14R1.1025 CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0064 [0,2,0,0,0,0|1,0,0]=3 561 B14R1.1025 CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0064 [0,2,0,0,0,0|1,0,0]=3 562 B14R1.1025 CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0064 [0,2,0,0,0,0|1,0,0]=3 563 B14R1.1025 CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0064 [0,2,0,0,0,0|1,0,0]=3 564 B14R1.1025 CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0064 [0,2,0,0,0,0|1,0,0]=3 565 B14R1.1025 CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0064 [0,2,0,0,0,0|1,0,0]=3 566 B14R1.1025 CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0064 [0,2,0,0,0,0|1,0,0]=3 567 B14R1.1025 Cc1cccc(c1)CCNC(=O)CO WXVL_AK8219SB2706 [0,2,0,0,0,0|1,0,0]=3 568 B14R1.1025 Cc1cccc(c1)CCNC(=O)CO WXVL_AK8219SB2706 [0,2,0,0,0,0|1,0,0]=3 569 B14R1.1025 O=C(CO)NCCc1cccc(c1)Br WXVL_AK0800SB2706 [0,2,0,0,0,0|1,0,0]=3 570 B14R1.1025 O=C(CO)NCCc1cccc(c1)Br WXVL_AK0800SB2706 [0,2,0,0,0,0|1,0,0]=3 571 B14R1.1025 O=C(CO)NCCc1cccc(c1)Cl WXVL_AK0776SB2706 [0,2,0,0,0,0|1,0,0]=3 572 B14R1.1025 O=C(CO)NCCc1cccc(c1)Cl WXVL_AK0776SB2706 [0,2,0,0,0,0|1,0,0]=3 573 B14R1.1025 O=C(CO)NCCc1cccc(c1)F WXVL_AK0117SB2706 [0,2,0,0,0,0|1,0,0]=3 574 B14R1.1025 O=C(CO)NCCc1cccc(c1)F WXVL_AK0117SB2706 [0,2,0,0,0,0|1,0,0]=3 575 B14R1.1025 O=C(CO)NCCc1cccc(c1)O WXVL_AK00421SB2706 [0,2,0,0,0,0|1,0,0]=3 576 B14R1.1025 O=C(CO)NCCc1cccc(c1)O WXVL_AK00421SB2706 [0,2,0,0,0,0|1,0,0]=3 577 B14R1.4250 CC(=O)NCCc1cc(cc(c1)Cl)Cl WXVL_AK2851SB0150 [0,2,0,0,0,0|1,0,0]=3 578 B14R1.4250 CC(=O)NCCc1cc(cc(c1)Cl)Cl WXVL_AK2851SB0150 [0,2,0,0,0,0|1,0,0]=3 579 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)Br WXVL_AK1177SB0051 [0,2,0,0,0,0|2,0,0]=4 580 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)Br WXVL_AK1177SB0051 [0,2,0,0,0,0|2,0,0]=4 581 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)C WXVL_AK0045SB0051 [0,2,0,0,0,0|2,0,0]=4 582 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)C WXVL_AK0045SB0051 [0,2,0,0,0,0|2,0,0]=4 583 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0051 [0,2,0,0,0,0|2,0,0]=4 584 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0051 [0,2,0,0,0,0|2,0,0]=4 585 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)F WXVL_AK0041SB0051 [0,2,0,0,0,0|2,0,0]=4 586 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)F WXVL_AK0041SB0051 [0,2,0,0,0,0|2,0,0]=4 587 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)I WXVL_AK1572SB0051 [0,2,0,0,0,0|2,0,0]=4 588 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)I WXVL_AK1572SB0051 [0,2,0,0,0,0|2,0,0]=4 589 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)O WXVL_AK0974SB0051 [0,2,0,0,0,0|2,0,0]=4 590 B14R1.5956 CC(=O)C(=O)NCc1cccc(c1)O WXVL_AK0974SB0051 [0,2,0,0,0,0|2,0,0]=4 591 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C WXVL_AN3025SB0150 [0,2,0,0,0,0|1,0,0]=3 592 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C WXVL_AN3025SB0150 [0,2,0,0,0,0|1,0,0]=3 593 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F WXVL_AN5203SB0150 [0,2,0,0,0,0|1,0,0]=3 594 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F WXVL_AN5203SB0150 [0,2,0,0,0,0|1,0,0]=3 595 B14R1.5978 CC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0150 [0,2,0,0,0,0|1,0,0]=3 596 B14R1.5978 CC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0150 [0,2,0,0,0,0|1,0,0]=3 597 B14R1.6072 CC(=O)NCCc1cc(ccc1Cl)Cl WXVL_AK0419SB0150 [0,2,0,0,0,0|1,0,0]=3 598 B14R1.6072 CC(=O)NCCc1cc(ccc1Cl)Cl WXVL_AK0419SB0150 [0,2,0,0,0,0|1,0,0]=3 599 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,2,0,0,0,0|1,0,0]=3 600 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,2,0,0,0,0|1,0,0]=3 601 B14R1.96 COc1cnccc1CCNC(=O)C WXVL_AK00188SB0150 [0,2,0,0,0,0|2,0,0]=4 602 B14R1.96 COc1cnccc1CCNC(=O)C WXVL_AK00188SB0150 [0,2,0,0,0,0|2,0,0]=4 603 B14R1.161 CC(=O)C(=O)NCc1ccccc1Br WXVL_AK1632SB0051 [0,2,0,0,0,0|2,0,0]=4 604 B14R1.161 CC(=O)C(=O)NCc1ccccc1Br WXVL_AK1632SB0051 [0,2,0,0,0,0|2,0,0]=4 605 B14R1.161 CC(=O)C(=O)NCc1ccccc1C WXVL_AK0040SB0051 [0,2,0,0,0,0|2,0,0]=4 606 B14R1.161 CC(=O)C(=O)NCc1ccccc1C WXVL_AK0040SB0051 [0,2,0,0,0,0|2,0,0]=4 607 B14R1.161 CC(=O)C(=O)NCc1ccccc1Cl WXVL_AK0038SB0051 [0,2,0,0,0,0|2,0,0]=4 608 B14R1.161 CC(=O)C(=O)NCc1ccccc1Cl WXVL_AK0038SB0051 [0,2,0,0,0,0|2,0,0]=4 609 B14R1.161 CC(=O)C(=O)NCc1ccccc1F WXVL_AK0037SB0051 [0,2,0,0,0,0|2,0,0]=4 610 B14R1.161 CC(=O)C(=O)NCc1ccccc1F WXVL_AK0037SB0051 [0,2,0,0,0,0|2,0,0]=4 611 B14R1.161 CC(=O)C(=O)NCc1ccccc1I WXVL_AK3923SB0051 [0,2,0,0,0,0|2,0,0]=4 612 B14R1.161 CC(=O)C(=O)NCc1ccccc1I WXVL_AK3923SB0051 [0,2,0,0,0,0|2,0,0]=4 613 B14R1.161 CC(=O)C(=O)NCc1ccccc1O WXVL_AK0963SB0051 [0,2,0,0,0,0|2,0,0]=4 614 B14R1.161 CC(=O)C(=O)NCc1ccccc1O WXVL_AK0963SB0051 [0,2,0,0,0,0|2,0,0]=4 615 B14R1.837 C#CC(=O)NCCc1ccccc1Br WXVL_AK0778SB0338 [0,2,0,0,0,0|1,0,1]=4 616 B14R1.837 C#CC(=O)NCCc1ccccc1Br WXVL_AK0778SB0338 [0,2,0,0,0,0|1,0,1]=4 617 B14R1.837 C#CC(=O)NCCc1ccccc1C WXVL_AK0254SB0338 [0,2,0,0,0,0|1,0,1]=4 618 B14R1.837 C#CC(=O)NCCc1ccccc1C WXVL_AK0254SB0338 [0,2,0,0,0,0|1,0,1]=4 619 B14R1.837 C#CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0338 [0,2,0,0,0,0|1,0,1]=4 620 B14R1.837 C#CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0338 [0,2,0,0,0,0|1,0,1]=4 621 B14R1.837 C#CC(=O)NCCc1ccccc1F WXVL_AK0118SB0338 [0,2,0,0,0,0|1,0,1]=4 622 B14R1.837 C#CC(=O)NCCc1ccccc1F WXVL_AK0118SB0338 [0,2,0,0,0,0|1,0,1]=4 623 B14R1.837 C#CC(=O)NCCc1ccccc1O WXVL_AK2884SB0338 [0,2,0,0,0,0|1,0,1]=4 624 B14R1.837 C#CC(=O)NCCc1ccccc1O WXVL_AK2884SB0338 [0,2,0,0,0,0|1,0,1]=4 625 B14R1.837 CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0064 [0,2,0,0,0,0|1,0,0]=3 626 B14R1.837 CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0064 [0,2,0,0,0,0|1,0,0]=3 627 B14R1.837 CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0064 [0,2,0,0,0,0|1,0,0]=3 628 B14R1.837 CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0064 [0,2,0,0,0,0|1,0,0]=3 629 B14R1.837 CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0064 [0,2,0,0,0,0|1,0,0]=3 630 B14R1.837 CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0064 [0,2,0,0,0,0|1,0,0]=3 631 B14R1.837 CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0064 [0,2,0,0,0,0|1,0,0]=3 632 B14R1.837 CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0064 [0,2,0,0,0,0|1,0,0]=3 633 B14R1.837 CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0064 [0,2,0,0,0,0|1,0,0]=3 634 B14R1.837 CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0064 [0,2,0,0,0,0|1,0,0]=3 635 B14R1.837 CNC(=O)CCCc1ccccc1F WXVL_AK00442SB3843 [0,2,0,0,0,0|1,0,0]=3 636 B14R1.837 CNC(=O)CCCc1ccccc1F WXVL_AK00442SB3843 [0,2,0,0,0,0|1,0,0]=3 637 B14R1.837 CNC(=O)CCOc1ccccc1Br WXVL_AK00442SB6717 [0,2,0,0,0,0|2,0,0]=4 638 B14R1.837 CNC(=O)CCOc1ccccc1Br WXVL_AK00442SB6717 [0,2,0,0,0,0|2,0,0]=4 639 B14R1.837 Cc1ccccc1CCNC(=O)CO WXVL_AK0254SB2706 [0,2,0,0,0,0|1,0,0]=3 640 B14R1.837 Cc1ccccc1CCNC(=O)CO WXVL_AK0254SB2706 [0,2,0,0,0,0|1,0,0]=3 641 B14R1.837 O=C(CO)NCCc1ccccc1Br WXVL_AK0778SB2706 [0,2,0,0,0,0|1,0,0]=3 642 B14R1.837 O=C(CO)NCCc1ccccc1Br WXVL_AK0778SB2706 [0,2,0,0,0,0|1,0,0]=3 643 B14R1.837 O=C(CO)NCCc1ccccc1Cl WXVL_AK0715SB2706 [0,2,0,0,0,0|1,0,0]=3 644 B14R1.837 O=C(CO)NCCc1ccccc1Cl WXVL_AK0715SB2706 [0,2,0,0,0,0|1,0,0]=3 645 B14R1.837 O=C(CO)NCCc1ccccc1F WXVL_AK0118SB2706 [0,2,0,0,0,0|1,0,0]=3 646 B14R1.837 O=C(CO)NCCc1ccccc1F WXVL_AK0118SB2706 [0,2,0,0,0,0|1,0,0]=3 647 B14R1.837 O=C(CO)NCCc1ccccc1O WXVL_AK2884SB2706 [0,2,0,0,0,0|1,0,0]=3 648 B14R1.837 O=C(CO)NCCc1ccccc1O WXVL_AK2884SB2706 [0,2,0,0,0,0|1,0,0]=3 649 B14R1.4464 CC(=O)NCCc1ccc(cc1Cl)Cl WXVL_AK0889SB0150 [0,2,0,0,0,0|1,0,0]=3 650 B14R1.4464 CC(=O)NCCc1ccc(cc1Cl)Cl WXVL_AK0889SB0150 [0,2,0,0,0,0|1,0,0]=3 651 B14R1.4464 CC(=O)NCCc1ccc(cc1F)F WXVL_AK3943SB0150 [0,2,0,0,0,0|1,0,0]=3 652 B14R1.4464 CC(=O)NCCc1ccc(cc1F)F WXVL_AK3943SB0150 [0,2,0,0,0,0|1,0,0]=3 653 B14R1.4920 CC(=O)NCCc1c(cccc1Cl)Cl WXVL_AK0905SB0150 [0,2,0,0,0,0|1,0,0]=3 654 B14R1.4920 CC(=O)NCCc1c(cccc1Cl)Cl WXVL_AK0905SB0150 [0,2,0,0,0,0|1,0,0]=3 655 B14R1.4920 CC(=O)NCCc1c(cccc1Cl)F WXVL_AK0192SB0150 [0,2,0,0,0,0|1,0,0]=3 656 B14R1.4920 CC(=O)NCCc1c(cccc1Cl)F WXVL_AK0192SB0150 [0,2,0,0,0,0|1,0,0]=3 657 B14R1.425 CC(=O)C(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0051 [0,2,0,0,0,0|2,0,0]=4 658 B14R1.425 CC(=O)C(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0051 [0,2,0,0,0,0|2,0,0]=4 659 B14R1.549 CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0150 [0,2,0,0,0,0|1,0,0]=3 660 B14R1.549 CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0150 [0,2,0,0,0,0|1,0,0]=3 661 B14R1.743 CNC(=O)CC(C)Oc1ccccc1 WXVL_AK00442SA00047 [0,2,0,0,0,0|2,0,0]=4 662 B14R1.743 CNC(=O)CC(C)Oc1ccccc1 WXVL_AK00442SA00047 [0,2,0,0,0,0|2,0,0]=4 663 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0051 [0,2,0,0,0,0|2,0,0]=4 664 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0051 [0,2,0,0,0,0|2,0,0]=4 665 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)C WXVL_AK0048SB0051 [0,2,0,0,0,0|2,0,0]=4 666 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)C WXVL_AK0048SB0051 [0,2,0,0,0,0|2,0,0]=4 667 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0051 [0,2,0,0,0,0|2,0,0]=4 668 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0051 [0,2,0,0,0,0|2,0,0]=4 669 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)F WXVL_AK0046SB0051 [0,2,0,0,0,0|2,0,0]=4 670 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)F WXVL_AK0046SB0051 [0,2,0,0,0,0|2,0,0]=4 671 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)I WXVL_AK1644SB0051 [0,2,0,0,0,0|2,0,0]=4 672 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)I WXVL_AK1644SB0051 [0,2,0,0,0,0|2,0,0]=4 673 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)O WXVL_AK0926SB0051 [0,2,0,0,0,0|2,0,0]=4 674 B14R1.679 CC(=O)C(=O)NCc1ccc(cc1)O WXVL_AK0926SB0051 [0,2,0,0,0,0|2,0,0]=4 675 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl WXVL_AN3038SB0150 [0,2,0,0,0,0|1,0,0]=3 676 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl WXVL_AN3038SB0150 [0,2,0,0,0,0|1,0,0]=3 677 B14R1.756 CCC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0344 [0,2,0,0,0,0|2,0,0]=4 678 B14R1.756 CCC(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB0344 [0,2,0,0,0,0|2,0,0]=4 679 B14R1.4 COc1ccc(cc1)CCNC(=O)C WXVL_AK2321SB0150 [0,2,0,0,0,0|1,0,0]=3 680 B14R1.4 COc1ccc(cc1)CCNC(=O)C WXVL_AK2321SB0150 [0,2,0,0,0,0|1,0,0]=3 681 B14R1.13 C#CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0338 [0,2,0,0,0,0|1,0,1]=4 682 B14R1.13 C#CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0338 [0,2,0,0,0,0|1,0,1]=4 683 B14R1.13 C#CC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0338 [0,2,0,0,0,0|1,0,1]=4 684 B14R1.13 C#CC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0338 [0,2,0,0,0,0|1,0,1]=4 685 B14R1.13 C#CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0338 [0,2,0,0,0,0|1,0,1]=4 686 B14R1.13 C#CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0338 [0,2,0,0,0,0|1,0,1]=4 687 B14R1.13 C#CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0338 [0,2,0,0,0,0|1,0,1]=4 688 B14R1.13 C#CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0338 [0,2,0,0,0,0|1,0,1]=4 689 B14R1.13 C#CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0338 [0,2,0,0,0,0|1,0,1]=4 690 B14R1.13 C#CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0338 [0,2,0,0,0,0|1,0,1]=4 691 B14R1.13 CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0064 [0,2,0,0,0,0|1,0,0]=3 692 B14R1.13 CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0064 [0,2,0,0,0,0|1,0,0]=3 693 B14R1.13 CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0064 [0,2,0,0,0,0|1,0,0]=3 694 B14R1.13 CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0064 [0,2,0,0,0,0|1,0,0]=3 695 B14R1.13 CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0064 [0,2,0,0,0,0|1,0,0]=3 696 B14R1.13 CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0064 [0,2,0,0,0,0|1,0,0]=3 697 B14R1.13 CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0064 [0,2,0,0,0,0|1,0,0]=3 698 B14R1.13 CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0064 [0,2,0,0,0,0|1,0,0]=3 699 B14R1.13 CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0064 [0,2,0,0,0,0|1,0,0]=3 700 B14R1.13 CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0064 [0,2,0,0,0,0|1,0,0]=3 701 B14R1.13 CNC(=O)CCCc1ccc(cc1)Br WXVL_AK00442SB4477 [0,2,0,0,0,0|1,0,0]=3 702 B14R1.13 CNC(=O)CCCc1ccc(cc1)Br WXVL_AK00442SB4477 [0,2,0,0,0,0|1,0,0]=3 703 B14R1.13 CNC(=O)CCCc1ccc(cc1)F WXVL_AK00442SB1490 [0,2,0,0,0,0|1,0,0]=3 704 B14R1.13 CNC(=O)CCCc1ccc(cc1)F WXVL_AK00442SB1490 [0,2,0,0,0,0|1,0,0]=3 705 B14R1.13 CNC(=O)CCOc1ccc(cc1)Br WXVL_AK00442SB0800 [0,2,0,0,0,0|2,0,0]=4 706 B14R1.13 CNC(=O)CCOc1ccc(cc1)Br WXVL_AK00442SB0800 [0,2,0,0,0,0|2,0,0]=4 707 B14R1.13 CNC(=O)CCOc1ccc(cc1)C WXVL_AK00442SB0468 [0,2,0,0,0,0|2,0,0]=4 708 B14R1.13 CNC(=O)CCOc1ccc(cc1)C WXVL_AK00442SB0468 [0,2,0,0,0,0|2,0,0]=4 709 B14R1.13 CNC(=O)CCOc1ccc(cc1)F WXVL_AK00442SB0479 [0,2,0,0,0,0|2,0,0]=4 710 B14R1.13 CNC(=O)CCOc1ccc(cc1)F WXVL_AK00442SB0479 [0,2,0,0,0,0|2,0,0]=4 711 B14R1.13 Cc1ccc(cc1)CCNC(=O)CO WXVL_AK0066SB2706 [0,2,0,0,0,0|1,0,0]=3 712 B14R1.13 Cc1ccc(cc1)CCNC(=O)CO WXVL_AK0066SB2706 [0,2,0,0,0,0|1,0,0]=3 713 B14R1.13 O=C(CO)NCCc1ccc(cc1)Br WXVL_AK0745SB2706 [0,2,0,0,0,0|1,0,0]=3 714 B14R1.13 O=C(CO)NCCc1ccc(cc1)Br WXVL_AK0745SB2706 [0,2,0,0,0,0|1,0,0]=3 715 B14R1.13 O=C(CO)NCCc1ccc(cc1)Cl WXVL_AK1369SB2706 [0,2,0,0,0,0|1,0,0]=3 716 B14R1.13 O=C(CO)NCCc1ccc(cc1)Cl WXVL_AK1369SB2706 [0,2,0,0,0,0|1,0,0]=3 717 B14R1.13 O=C(CO)NCCc1ccc(cc1)F WXVL_AK0123SB2706 [0,2,0,0,0,0|1,0,0]=3 718 B14R1.13 O=C(CO)NCCc1ccc(cc1)F WXVL_AK0123SB2706 [0,2,0,0,0,0|1,0,0]=3 719 B14R1.13 O=C(CO)NCCc1ccc(cc1)O WXVL_AK0748SB2706 [0,2,0,0,0,0|1,0,0]=3 720 B14R1.13 O=C(CO)NCCc1ccc(cc1)O WXVL_AK0748SB2706 [0,2,0,0,0,0|1,0,0]=3 721 B14R1.292 CCS(=O)(=O)NCCc1ccccc1 WXVL_AK00498HU0028 [0,2,0,0,0,0|2,0,0]=4 722 B14R1.292 CCS(=O)(=O)NCCc1ccccc1 WXVL_AK00498HU0028 [0,2,0,0,0,0|2,0,0]=4 723 B14R1.520 C#CCC(=O)NCCc1ccccc1 WXVL_AK00498SB3070 [0,2,0,0,0,0|1,0,0]=3 724 B14R1.520 C#CCC(=O)NCCc1ccccc1 WXVL_AK00498SB3070 [0,2,0,0,0,0|1,0,0]=3 725 B14R1.520 C#CCC(=O)NCCc1ccccn1 WXVL_AK0019SB3070 [0,2,0,0,0,0|2,0,0]=4 726 B14R1.520 C#CCC(=O)NCCc1ccccn1 WXVL_AK0019SB3070 [0,2,0,0,0,0|2,0,0]=4 727 B14R1.520 C#CCC(=O)NCCc1cccnc1 WXVL_AK00436SB3070 [0,2,0,0,0,0|2,0,0]=4 728 B14R1.520 C#CCC(=O)NCCc1cccnc1 WXVL_AK00436SB3070 [0,2,0,0,0,0|2,0,0]=4 729 B14R1.520 C#CCC(=O)NCCc1ccncc1 WXVL_AK0093SB3070 [0,2,0,0,0,0|2,0,0]=4 730 B14R1.520 C#CCC(=O)NCCc1ccncc1 WXVL_AK0093SB3070 [0,2,0,0,0,0|2,0,0]=4 731 B14R1.520 C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0340 [0,2,0,0,0,0|1,0,0]=3 732 B14R1.520 C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0340 [0,2,0,0,0,0|1,0,0]=3 733 B14R1.520 C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0340 [0,2,0,0,0,0|2,0,0]=4 734 B14R1.520 C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0340 [0,2,0,0,0,0|2,0,0]=4 735 B14R1.520 C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0340 [0,2,0,0,0,0|2,0,0]=4 736 B14R1.520 C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0340 [0,2,0,0,0,0|2,0,0]=4 737 B14R1.520 C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0340 [0,2,0,0,0,0|2,0,0]=4 738 B14R1.520 C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0340 [0,2,0,0,0,0|2,0,0]=4 739 B14R1.520 C=CCC(=O)NCCc1ccccc1 WXVL_AK00498SB2732 [0,2,0,0,0,0|1,0,0]=3 740 B14R1.520 C=CCC(=O)NCCc1ccccc1 WXVL_AK00498SB2732 [0,2,0,0,0,0|1,0,0]=3 741 B14R1.520 C=CCC(=O)NCCc1ccccn1 WXVL_AK0019SB2732 [0,2,0,0,0,0|2,0,0]=4 742 B14R1.520 C=CCC(=O)NCCc1ccccn1 WXVL_AK0019SB2732 [0,2,0,0,0,0|2,0,0]=4 743 B14R1.520 C=CCC(=O)NCCc1cccnc1 WXVL_AK00436SB2732 [0,2,0,0,0,0|2,0,0]=4 744 B14R1.520 C=CCC(=O)NCCc1cccnc1 WXVL_AK00436SB2732 [0,2,0,0,0,0|2,0,0]=4 745 B14R1.520 C=CCC(=O)NCCc1ccncc1 WXVL_AK0093SB2732 [0,2,0,0,0,0|2,0,0]=4 746 B14R1.520 C=CCC(=O)NCCc1ccncc1 WXVL_AK0093SB2732 [0,2,0,0,0,0|2,0,0]=4 747 B14R1.520 CC#CC(=O)NCCc1ccccc1 WXVL_AK00498SB1240 [0,2,0,0,0,0|1,0,0]=3 748 B14R1.520 CC#CC(=O)NCCc1ccccc1 WXVL_AK00498SB1240 [0,2,0,0,0,0|1,0,0]=3 749 B14R1.520 CC#CC(=O)NCCc1ccccn1 WXVL_AK0019SB1240 [0,2,0,0,0,0|2,0,0]=4 750 B14R1.520 CC#CC(=O)NCCc1ccccn1 WXVL_AK0019SB1240 [0,2,0,0,0,0|2,0,0]=4 751 B14R1.520 CC#CC(=O)NCCc1cccnc1 WXVL_AK00436SB1240 [0,2,0,0,0,0|2,0,0]=4 752 B14R1.520 CC#CC(=O)NCCc1cccnc1 WXVL_AK00436SB1240 [0,2,0,0,0,0|2,0,0]=4 753 B14R1.520 CC#CC(=O)NCCc1ccncc1 WXVL_AK0093SB1240 [0,2,0,0,0,0|2,0,0]=4 754 B14R1.520 CC#CC(=O)NCCc1ccncc1 WXVL_AK0093SB1240 [0,2,0,0,0,0|2,0,0]=4 755 B14R1.520 CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0073 [0,2,0,0,0,0|1,0,0]=3 756 B14R1.520 CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0073 [0,2,0,0,0,0|1,0,0]=3 757 B14R1.520 CCCC(=O)NCCc1ccccn1 WXVL_AK0019SB0073 [0,2,0,0,0,0|2,0,0]=4 758 B14R1.520 CCCC(=O)NCCc1ccccn1 WXVL_AK0019SB0073 [0,2,0,0,0,0|2,0,0]=4 759 B14R1.520 CCCC(=O)NCCc1cccnc1 WXVL_AK00436SB0073 [0,2,0,0,0,0|2,0,0]=4 760 B14R1.520 CCCC(=O)NCCc1cccnc1 WXVL_AK00436SB0073 [0,2,0,0,0,0|2,0,0]=4 761 B14R1.520 CCCC(=O)NCCc1ccncc1 WXVL_AK0093SB0073 [0,2,0,0,0,0|2,0,0]=4 762 B14R1.520 CCCC(=O)NCCc1ccncc1 WXVL_AK0093SB0073 [0,2,0,0,0,0|2,0,0]=4 763 B14R1.520 CCNC(=O)CCCc1ccccc1 WXVL_AK00476SB0121 [0,2,0,0,0,0|1,0,0]=3 764 B14R1.520 CCNC(=O)CCCc1ccccc1 WXVL_AK00476SB0121 [0,2,0,0,0,0|1,0,0]=3 765 B14R1.520 CCNC(=O)CCOc1ccccc1 WXVL_AK00476SB0066 [0,2,0,0,0,0|2,0,0]=4 766 B14R1.520 CCNC(=O)CCOc1ccccc1 WXVL_AK00476SB0066 [0,2,0,0,0,0|2,0,0]=4 767 B14R1.520 CCNC(=O)COCc1ccccc1 WXVL_AK00476SB0185 [0,2,0,0,0,0|2,0,0]=4 768 B14R1.520 CCNC(=O)COCc1ccccc1 WXVL_AK00476SB0185 [0,2,0,0,0,0|2,0,0]=4 769 B14R1.520 COCC(=O)NCCc1ccccc1 WXVL_AK00498SB0090 [0,2,0,0,0,0|1,0,0]=3 770 B14R1.520 COCC(=O)NCCc1ccccc1 WXVL_AK00498SB0090 [0,2,0,0,0,0|1,0,0]=3 771 B14R1.520 COCC(=O)NCCc1ccccn1 WXVL_AK0019SB0090 [0,2,0,0,0,0|2,0,0]=4 772 B14R1.520 COCC(=O)NCCc1ccccn1 WXVL_AK0019SB0090 [0,2,0,0,0,0|2,0,0]=4 773 B14R1.520 COCC(=O)NCCc1cccnc1 WXVL_AK00436SB0090 [0,2,0,0,0,0|2,0,0]=4 774 B14R1.520 COCC(=O)NCCc1cccnc1 WXVL_AK00436SB0090 [0,2,0,0,0,0|2,0,0]=4 775 B14R1.520 COCC(=O)NCCc1ccncc1 WXVL_AK0093SB0090 [0,2,0,0,0,0|2,0,0]=4 776 B14R1.520 COCC(=O)NCCc1ccncc1 WXVL_AK0093SB0090 [0,2,0,0,0,0|2,0,0]=4 777 B14R1.520 CSCC(=O)NCCc1ccccc1 WXVL_AK00498SB1267 [0,2,0,0,0,0|1,0,0]=3 778 B14R1.520 CSCC(=O)NCCc1ccccc1 WXVL_AK00498SB1267 [0,2,0,0,0,0|1,0,0]=3 779 B14R1.520 CSCC(=O)NCCc1ccccn1 WXVL_AK0019SB1267 [0,2,0,0,0,0|2,0,0]=4 780 B14R1.520 CSCC(=O)NCCc1ccccn1 WXVL_AK0019SB1267 [0,2,0,0,0,0|2,0,0]=4 781 B14R1.520 CSCC(=O)NCCc1cccnc1 WXVL_AK00436SB1267 [0,2,0,0,0,0|2,0,0]=4 782 B14R1.520 CSCC(=O)NCCc1cccnc1 WXVL_AK00436SB1267 [0,2,0,0,0,0|2,0,0]=4 783 B14R1.520 CSCC(=O)NCCc1ccncc1 WXVL_AK0093SB1267 [0,2,0,0,0,0|2,0,0]=4 784 B14R1.520 CSCC(=O)NCCc1ccncc1 WXVL_AK0093SB1267 [0,2,0,0,0,0|2,0,0]=4 785 B14R1.520 N#CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0057 [0,2,0,0,0,0|1,0,0]=3 786 B14R1.520 N#CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0057 [0,2,0,0,0,0|1,0,0]=3 787 B14R1.520 N#CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0057 [0,2,0,0,0,0|2,0,0]=4 788 B14R1.520 N#CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0057 [0,2,0,0,0,0|2,0,0]=4 789 B14R1.520 N#CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0057 [0,2,0,0,0,0|2,0,0]=4 790 B14R1.520 N#CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0057 [0,2,0,0,0,0|2,0,0]=4 791 B14R1.520 N#CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0057 [0,2,0,0,0,0|2,0,0]=4 792 B14R1.520 N#CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0057 [0,2,0,0,0,0|2,0,0]=4 793 B14R2.2 CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB0150 [0,0,0,1,0,1|1,0,0]=3 794 B14R2.2 CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB0150 [0,0,0,1,0,1|1,0,0]=3 795 B14R2.2 CC(=O)NC1CCc2c1nccc2 WXVL_AK2236SB0150 [0,0,0,1,0,1|2,0,0]=4 796 B14R2.2 CC(=O)NC1CCc2c1nccc2 WXVL_AK2236SB0150 [0,0,0,1,0,1|2,0,0]=4 797 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,0,0,1,0,1|1,0,0]=3 798 B14R2.2 CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB0150 [0,0,0,1,0,1|1,0,0]=3 799 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB0150 [0,0,0,1,0,1|1,0,0]=3 800 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB0150 [0,0,0,1,0,1|1,0,0]=3 801 B14R2.19 O=C1C[C@@H](CO1)Nc2ccncn2 WXVL_AK00458LP3358 [0,0,0,1,0,1|2,0,0]=4 802 B14R2.19 O=C1C[C@@H](CO1)Nc2ccncn2 WXVL_AK00458LP3358 [0,0,0,1,0,1|2,0,0]=4 803 B14R2.19 O=C1C[C@@H](CO1)Nc2ncccn2 WXVL_AK00458LP0002 [0,0,0,1,0,1|2,0,0]=4 804 B14R2.19 O=C1C[C@@H](CO1)Nc2ncccn2 WXVL_AK00458LP0002 [0,0,0,1,0,1|2,0,0]=4 805 B14R2.21 O=C1CN(CCO1)c2ccncn2 WXVL_AN4960LP3358 [0,0,0,1,0,1|2,0,0]=4 806 B14R2.21 O=C1CN(CCO1)c2ncccn2 WXVL_AN4960LP0002 [0,0,0,1,0,1|2,0,0]=4 807 B14R2.780 CC(=O)N1CCC1c2ccccc2 WXVL_AN3661SB0150 [0,0,0,1,0,1|1,0,0]=3 808 B14R2.31359 NC(=O)[C@H]1CCCc2c1cccc2 WXVL_AK0084SB4181 [0,0,0,1,0,1|2,0,0]=4 809 B14R2.31359 NC(=O)[C@H]1CCCc2c1cccc2 WXVL_AK0084SB4181 [0,0,0,1,0,1|2,0,0]=4 810 B14R2.8053 NC(=O)C1CCc2c1c(ccc2)Cl WXVL_AK0084SA00029 [0,1,0,1,0,0|2,0,0]=4 811 B14R2.8053 NC(=O)C1CCc2c1c(ccc2)Cl WXVL_AK0084SA00029 [0,1,0,1,0,0|2,0,0]=4 812 B14R2.768 NC(=O)CC1Cc2ccccc2C1 WXVL_AK0084SB0756 [0,1,0,1,0,0|2,0,0]=4 813 B14R2.768 NC(=O)CC1Cc2ccccc2C1 WXVL_AK0084SB0756 [0,1,0,1,0,0|2,0,0]=4 814 B14R2.781 CC(=O)N1CCc2ccccc2C1 WXVL_AN00480SB0150 [0,1,0,1,0,0|1,0,0]=3 815 B14R2.781 CC(=O)N1CCc2ccccc2C1 WXVL_AN00480SB0150 [0,1,0,1,0,0|1,0,0]=3 816 B14R2.781 CC(=O)N1CCc2cccnc2C1 WXVL_AN00388SB0150 [0,1,0,1,0,0|2,0,0]=4 817 B14R2.781 CC(=O)N1CCc2cccnc2C1 WXVL_AN00388SB0150 [0,1,0,1,0,0|2,0,0]=4 818 B14R2.781 CC(=O)N1CCc2ccncc2C1 WXVL_AN00244SB0150 [0,1,0,1,0,0|2,0,0]=4 819 B14R2.781 CC(=O)N1CCc2ccncc2C1 WXVL_AN00244SB0150 [0,1,0,1,0,0|2,0,0]=4 820 B14R2.781 CC(=O)N1CCc2cnccc2C1 WXVL_AN0182SB0150 [0,1,0,1,0,0|2,0,0]=4 821 B14R2.781 CC(=O)N1CCc2cnccc2C1 WXVL_AN0182SB0150 [0,1,0,1,0,0|2,0,0]=4 822 B14R2.781 CC(=O)N1CCc2ncccc2C1 WXVL_AN00470SB0150 [0,1,0,1,0,0|2,0,0]=4 823 B14R2.781 CC(=O)N1CCc2ncccc2C1 WXVL_AN00470SB0150 [0,1,0,1,0,0|2,0,0]=4 824 B14R2.781 NC(=O)C1CCc2ccccc2C1 WXVL_AK0084SB0455 [0,1,0,1,0,0|2,0,0]=4 825 B14R2.781 NC(=O)C1CCc2ccccc2C1 WXVL_AK0084SB0455 [0,1,0,1,0,0|2,0,0]=4 826 B14R2.781 NC(=O)C1CCc2ccccc2O1 WXVL_AK0084SB2497 [0,1,0,1,0,0|2,0,0]=4 827 B14R2.781 NC(=O)C1CCc2ccccc2O1 WXVL_AK0084SB2497 [0,1,0,1,0,0|2,0,0]=4 828 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK0084SB0852 [0,1,0,1,0,0|2,0,0]=4 829 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK0084SB0852 [0,1,0,1,0,0|2,0,0]=4 830 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)F WXVL_AK0084SB3469 [0,1,0,1,0,0|2,0,0]=4 831 B14R2.4402 NC(=O)C1CC1c2ccc(cc2)F WXVL_AK0084SB3469 [0,1,0,1,0,0|2,0,0]=4 832 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK0084SB6328 [0,1,0,1,0,0|2,0,0]=4 833 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK0084SB6328 [0,1,0,1,0,0|2,0,0]=4 834 B14R2.95 CNC(=O)C1CCc2c1cccc2 WXVL_AK00442SB3073 [0,1,0,1,0,0|1,0,0]=3 835 B14R2.95 CNC(=O)C1CCc2c1cccc2 WXVL_AK00442SB3073 [0,1,0,1,0,0|1,0,0]=3 836 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [0,1,0,1,0,0|1,0,0]=3 837 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [0,1,0,1,0,0|1,0,0]=3 838 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [0,1,0,1,0,0|1,0,0]=3 839 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [0,1,0,1,0,0|1,0,0]=3 840 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,2,0|1,0,0]=3 841 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,2,0|1,0,0]=3 842 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,2,0|2,0,0]=4 843 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,2,0|2,0,0]=4 844 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,2,0|1,0,0]=3 845 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,2,0|1,0,0]=3 846 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [0,0,0,0,2,0|2,0,0]=4 847 B10R1.18 NC(=O)Cc1ccccn1 WXVL_AK0084SA0032 [0,0,0,0,2,0|2,0,0]=4 848 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [0,0,0,0,2,0|2,0,0]=4 849 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SA0029 [0,0,0,0,2,0|2,0,0]=4 850 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [0,0,0,0,2,0|2,0,0]=4 851 B10R1.18 NC(=O)Cc1cccnc1 WXVL_AK0084SB00049 [0,0,0,0,2,0|2,0,0]=4 852 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [0,0,0,0,2,0|2,0,0]=4 853 B10R1.18 NC(=O)Cc1ccncc1 WXVL_AK0084SA00106 [0,0,0,0,2,0|2,0,0]=4 854 B10R1.66 CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0150 [0,0,0,0,2,0|2,0,0]=4 855 B10R1.66 CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0150 [0,0,0,0,2,0|2,0,0]=4 856 B10R1.66 CC(=O)NCc1ccco1 WXVL_AK0010SB0150 [0,0,0,0,2,0|2,0,0]=4 857 B10R1.66 CC(=O)NCc1ccco1 WXVL_AK0010SB0150 [0,0,0,0,2,0|2,0,0]=4 858 B10R1.66 CC(=O)NCc1cccs1 WXVL_AK0014SB0150 [0,0,0,0,2,0|2,0,0]=4 859 B10R1.66 CC(=O)NCc1cccs1 WXVL_AK0014SB0150 [0,0,0,0,2,0|2,0,0]=4 860 B10R1.66 CC(=O)NCc1ccoc1 WXVL_AK2033SB0150 [0,0,0,0,2,0|2,0,0]=4 861 B10R1.66 CC(=O)NCc1ccoc1 WXVL_AK2033SB0150 [0,0,0,0,2,0|2,0,0]=4 862 B10R1.66 CC(=O)NCc1ccsc1 WXVL_AK00174SB0150 [0,0,0,0,2,0|2,0,0]=4 863 B10R1.66 CC(=O)NCc1ccsc1 WXVL_AK00174SB0150 [0,0,0,0,2,0|2,0,0]=4 864 B10R1.66 NC(=O)CCc1ccc[nH]1 WXVL_AK0084SA0009 [0,0,0,0,2,0|2,0,0]=4 865 B10R1.66 NC(=O)CCc1ccc[nH]1 WXVL_AK0084SA0009 [0,0,0,0,2,0|2,0,0]=4 866 B10R1.66 NC(=O)CCc1ccco1 WXVL_AK0084SA0167 [0,0,0,0,2,0|2,0,0]=4 867 B10R1.66 NC(=O)CCc1ccco1 WXVL_AK0084SA0167 [0,0,0,0,2,0|2,0,0]=4 868 B10R1.66 NC(=O)CCc1cccs1 WXVL_AK0084SA0303 [0,0,0,0,2,0|2,0,0]=4 869 B10R1.66 NC(=O)CCc1cccs1 WXVL_AK0084SA0303 [0,0,0,0,2,0|2,0,0]=4 870 B10R1.66 NC(=O)CCc1ccoc1 WXVL_AK0084SA3178 [0,0,0,0,2,0|2,0,0]=4 871 B10R1.66 NC(=O)CCc1ccoc1 WXVL_AK0084SA3178 [0,0,0,0,2,0|2,0,0]=4 872 B10R1.66 NC(=O)CCc1ccsc1 WXVL_AK0084SA0008 [0,0,0,0,2,0|2,0,0]=4 873 B10R1.66 NC(=O)CCc1ccsc1 WXVL_AK0084SA0008 [0,0,0,0,2,0|2,0,0]=4 874 B14R1.422 CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB0150 [0,0,0,0,0,2|1,0,0]=3 875 B14R1.422 CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB0150 [0,0,0,0,0,2|1,0,0]=3 876 B14R1.422 CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB0150 [0,0,0,0,0,2|1,0,0]=3 877 B14R1.422 CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB0150 [0,0,0,0,0,2|1,0,0]=3 878 B14R1.422 CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB0150 [0,0,0,0,0,2|1,0,0]=3 879 B14R1.422 CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB0150 [0,0,0,0,0,2|1,0,0]=3