0 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,0,0|2,0,1]=3 22 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,0,0|2,0,1]=3 35 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,0,0|2,0,1]=3 36 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,0,0|2,0,1]=3 37 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,0,0|2,0,1]=3 38 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,0,0|2,0,1]=3 44 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,0,0|3,0,0]=3 46 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,0,0|2,0,0]=3 54 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,0,0|2,0,1]=4 68 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,0,0|2,0,1]=4 80 B8R1.7 NC(=O)c1nnc[nH]1 WXVL_AK0084SC00053 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.7 NC(=O)c1nnc[nH]1 WXVL_AK0084SC00053 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.6 CNS(=O)(=O)c1cccs1 WXVL_AK00442HU0005 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.6 CNS(=O)(=O)c1cccs1 WXVL_AK00442HU0005 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,0,0|1,0,1]=3 85 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,0,0|1,0,1]=3 86 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,0,0|1,0,1]=3 89 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,0,0|1,0,1]=3 90 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,0,0|1,0,0]=2 93 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,0,0|1,0,0]=2 94 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,0,0|1,0,1]=3 102 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,0,0|1,0,1]=3 105 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.11 CCNC(=O)c1cnon1 WXVL_AK00476SC0777 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.11 CCNC(=O)c1cnon1 WXVL_AK00476SC0777 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.11 CCNC(=O)c1cnsn1 WXVL_AK00476SC1291 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.11 CCNC(=O)c1cnsn1 WXVL_AK00476SC1291 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,0,0|1,0,1]=3 119 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,0,0|1,0,1]=3 122 B10R1.11 CCNC(=O)c1csnn1 WXVL_AK00476SC0002 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.11 CCNC(=O)c1csnn1 WXVL_AK00476SC0002 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.11 CCNC(=O)c1nc[nH]n1 WXVL_AK00476SC0376 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.11 CCNC(=O)c1nc[nH]n1 WXVL_AK00476SC0376 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,0,0|1,0,1]=3 127 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,0,0|1,0,1]=3 128 B10R1.11 CCNC(=O)c1nnc[nH]1 WXVL_AK00476SC00053 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.11 CCNC(=O)c1nnc[nH]1 WXVL_AK00476SC00053 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,0,0|1,0,0]=2 140 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,0,0|3,0,0]=4 151 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,0,0|2,0,1]=4 168 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,0,0|2,0,1]=4 192 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,0,0|2,0,1]=4 218 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,0,0|2,0,1]=4 225 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.23 CN(C)C(=O)c1nnc[nH]1 WXVL_AN0032SC00053 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.23 CN(C)C(=O)c1nnc[nH]1 WXVL_AN0032SC00053 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.23 NC(=O)C(=O)c1ccco1 WXVL_AK0084SA0049 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.23 NC(=O)C(=O)c1ccco1 WXVL_AK0084SA0049 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,0,0|1,0,0]=2 236 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.149 CNC(=O)c1cnnn1C WXVL_AK00442SC1006 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.149 CNC(=O)c1cnnn1C WXVL_AK00442SC1006 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.149 CNC(=O)c1ncnn1C WXVL_AK00442SC0037 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.149 CNC(=O)c1ncnn1C WXVL_AK00442SC0037 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,0,0|2,0,1]=4 262 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,0,0|2,0,1]=4 264 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,0,0|2,0,1]=4 266 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,0,0|2,0,0]=3 267 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,0,0|3,0,0]=4 286 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,0,1,0,0,0|1,0,2]=4 287 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,0,1,0,0,0|1,0,2]=4 288 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [0,0,1,0,0,0|2,0,0]=3 289 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [0,0,1,0,0,0|2,0,0]=3 290 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,0,1,0,0,0|2,0,1]=4 291 B8R0.6 C=CCCNC(=O)CC WXVL_AK00138SB0064 [0,0,1,0,0,0|2,0,1]=4 292 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,1|2,0,0]=3 293 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,1|2,0,0]=3 294 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,1|1,0,1]=3 295 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,1|1,0,1]=3 296 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,1|1,0,1]=3 297 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,1|1,0,1]=3 298 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,1|1,0,1]=3 299 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,1|1,0,1]=3 300 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,1|2,0,0]=3 301 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,1|2,0,0]=3 302 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,1|1,0,1]=3 303 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,1|1,0,1]=3 304 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,1|2,0,1]=4 305 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,1|2,0,1]=4 306 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,1|2,0,1]=4 307 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,1|2,0,1]=4 308 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,1|1,0,1]=3 309 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,1|1,0,1]=3 310 B10R1.27 C#CC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0338 [0,0,0,0,0,1|1,0,2]=4 311 B10R1.27 C#CC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0338 [0,0,0,0,0,1|1,0,2]=4 312 B10R1.27 C#CC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0338 [0,0,0,0,0,1|1,0,2]=4 313 B10R1.27 C#CC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0338 [0,0,0,0,0,1|1,0,2]=4 314 B10R1.27 C#CC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0338 [0,0,0,0,0,1|1,0,2]=4 315 B10R1.27 C#CC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0338 [0,0,0,0,0,1|1,0,2]=4 316 B10R1.27 CCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0064 [0,0,0,0,0,1|1,0,1]=3 317 B10R1.27 CCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0064 [0,0,0,0,0,1|1,0,1]=3 318 B10R1.27 CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0064 [0,0,0,0,0,1|1,0,0]=2 319 B10R1.27 CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0064 [0,0,0,0,0,1|1,0,0]=2 320 B10R1.27 CCC(=O)Nc1ccno1 WXVL_AF0588SB0064 [0,0,0,0,0,1|2,0,0]=3 321 B10R1.27 CCC(=O)Nc1ccno1 WXVL_AF0588SB0064 [0,0,0,0,0,1|2,0,0]=3 322 B10R1.27 CCC(=O)Nc1ccns1 WXVL_AF00325SB0064 [0,0,0,0,0,1|2,0,0]=3 323 B10R1.27 CCC(=O)Nc1ccns1 WXVL_AF00325SB0064 [0,0,0,0,0,1|2,0,0]=3 324 B10R1.27 CCC(=O)Nc1ccon1 WXVL_AF0028SB0064 [0,0,0,0,0,1|1,0,1]=3 325 B10R1.27 CCC(=O)Nc1ccon1 WXVL_AF0028SB0064 [0,0,0,0,0,1|1,0,1]=3 326 B10R1.27 CCC(=O)Nc1ccsc1 WXVL_AF00105SB0064 [0,0,0,0,0,1|2,0,0]=3 327 B10R1.27 CCC(=O)Nc1ccsc1 WXVL_AF00105SB0064 [0,0,0,0,0,1|2,0,0]=3 328 B10R1.27 CCC(=O)Nc1cn[nH]c1 WXVL_AF0097SB0064 [0,0,0,0,0,1|3,0,0]=4 329 B10R1.27 CCC(=O)Nc1cn[nH]c1 WXVL_AF0097SB0064 [0,0,0,0,0,1|3,0,0]=4 330 B10R1.27 CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0064 [0,0,0,0,0,1|1,0,0]=2 331 B10R1.27 CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0064 [0,0,0,0,0,1|1,0,0]=2 332 B10R1.27 CCC(=O)Nc1cncs1 WXVL_AF0724SB0064 [0,0,0,0,0,1|2,0,0]=3 333 B10R1.27 CCC(=O)Nc1cncs1 WXVL_AF0724SB0064 [0,0,0,0,0,1|2,0,0]=3 334 B10R1.27 CCC(=O)Nc1cnns1 WXVL_AF1103SB0064 [0,0,0,0,0,1|3,0,0]=4 335 B10R1.27 CCC(=O)Nc1cnns1 WXVL_AF1103SB0064 [0,0,0,0,0,1|3,0,0]=4 336 B10R1.27 CCC(=O)Nc1cnoc1 WXVL_AF0677SB0064 [0,0,0,0,0,1|3,0,0]=4 337 B10R1.27 CCC(=O)Nc1cnoc1 WXVL_AF0677SB0064 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.27 CCC(=O)Nc1cnsc1 WXVL_AF00176SB0064 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.27 CCC(=O)Nc1cnsc1 WXVL_AF00176SB0064 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.27 CCC(=O)Nc1cscn1 WXVL_AF00216SB0064 [0,0,0,0,0,1|1,0,1]=3 341 B10R1.27 CCC(=O)Nc1cscn1 WXVL_AF00216SB0064 [0,0,0,0,0,1|1,0,1]=3 342 B10R1.27 CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0064 [0,0,0,0,0,1|1,0,0]=2 343 B10R1.27 CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0064 [0,0,0,0,0,1|1,0,0]=2 344 B10R1.27 CCC(=O)Nc1ncco1 WXVL_AF0235SB0064 [0,0,0,0,0,1|1,0,1]=3 345 B10R1.27 CCC(=O)Nc1ncco1 WXVL_AF0235SB0064 [0,0,0,0,0,1|1,0,1]=3 346 B10R1.27 CCC(=O)Nc1nccs1 WXVL_AF0003SB0064 [0,0,0,0,0,1|1,0,1]=3 347 B10R1.27 CCC(=O)Nc1nccs1 WXVL_AF0003SB0064 [0,0,0,0,0,1|1,0,1]=3 348 B10R1.27 CCC(=O)Nc1ncns1 WXVL_AF2937SB0064 [0,0,0,0,0,1|2,0,1]=4 349 B10R1.27 CCC(=O)Nc1ncns1 WXVL_AF2937SB0064 [0,0,0,0,0,1|2,0,1]=4 350 B10R1.27 CCC(=O)Nc1nnco1 WXVL_AF0087SB0064 [0,0,0,0,0,1|2,0,1]=4 351 B10R1.27 CCC(=O)Nc1nnco1 WXVL_AF0087SB0064 [0,0,0,0,0,1|2,0,1]=4 352 B10R1.27 CNC(=O)Cc1cccs1 WXVL_AK00442SA0018 [0,0,0,0,0,1|2,0,0]=3 353 B10R1.27 CNC(=O)Cc1cccs1 WXVL_AK00442SA0018 [0,0,0,0,0,1|2,0,0]=3 354 B10R1.27 CNC(=O)Cc1ccn[nH]1 WXVL_AK00442SA00008 [0,0,0,0,0,1|2,0,0]=3 355 B10R1.27 CNC(=O)Cc1ccn[nH]1 WXVL_AK00442SA00008 [0,0,0,0,0,1|2,0,0]=3 356 B10R1.27 CNC(=O)Cc1ccsc1 WXVL_AK00442SA0020 [0,0,0,0,0,1|3,0,0]=4 357 B10R1.27 CNC(=O)Cc1ccsc1 WXVL_AK00442SA0020 [0,0,0,0,0,1|3,0,0]=4 358 B10R1.27 CNC(=O)Cc1cscn1 WXVL_AK00442SA0012 [0,0,0,0,0,1|2,0,1]=4 359 B10R1.27 CNC(=O)Cc1cscn1 WXVL_AK00442SA0012 [0,0,0,0,0,1|2,0,1]=4 360 B10R1.27 CNC(=O)Cn1cccn1 WXVL_AK00442SA0030 [0,0,0,0,0,1|2,0,1]=4 361 B10R1.27 CNC(=O)Cn1cccn1 WXVL_AK00442SA0030 [0,0,0,0,0,1|2,0,1]=4 362 B10R1.27 O=C(CO)Nc1cc[nH]n1 WXVL_AF2373SB2706 [0,0,0,0,0,1|2,0,1]=4 363 B10R1.27 O=C(CO)Nc1cc[nH]n1 WXVL_AF2373SB2706 [0,0,0,0,0,1|2,0,1]=4 364 B10R1.27 O=C(CO)Nc1ccn[nH]1 WXVL_AF0122SB2706 [0,0,0,0,0,1|2,0,0]=3 365 B10R1.27 O=C(CO)Nc1ccn[nH]1 WXVL_AF0122SB2706 [0,0,0,0,0,1|2,0,0]=3 366 B10R1.27 O=C(CO)Nc1ccno1 WXVL_AF0588SB2706 [0,0,0,0,0,1|3,0,0]=4 367 B10R1.27 O=C(CO)Nc1ccno1 WXVL_AF0588SB2706 [0,0,0,0,0,1|3,0,0]=4 368 B10R1.27 O=C(CO)Nc1ccns1 WXVL_AF00325SB2706 [0,0,0,0,0,1|3,0,0]=4 369 B10R1.27 O=C(CO)Nc1ccns1 WXVL_AF00325SB2706 [0,0,0,0,0,1|3,0,0]=4 370 B10R1.27 O=C(CO)Nc1ccon1 WXVL_AF0028SB2706 [0,0,0,0,0,1|2,0,1]=4 371 B10R1.27 O=C(CO)Nc1ccon1 WXVL_AF0028SB2706 [0,0,0,0,0,1|2,0,1]=4 372 B10R1.27 O=C(CO)Nc1ccsc1 WXVL_AF00105SB2706 [0,0,0,0,0,1|3,0,0]=4 373 B10R1.27 O=C(CO)Nc1ccsc1 WXVL_AF00105SB2706 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.27 O=C(CO)Nc1cnc[nH]1 WXVL_AF00103SB2706 [0,0,0,0,0,1|2,0,0]=3 375 B10R1.27 O=C(CO)Nc1cnc[nH]1 WXVL_AF00103SB2706 [0,0,0,0,0,1|2,0,0]=3 376 B10R1.27 O=C(CO)Nc1cncs1 WXVL_AF0724SB2706 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.27 O=C(CO)Nc1cncs1 WXVL_AF0724SB2706 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.27 O=C(CO)Nc1cscn1 WXVL_AF00216SB2706 [0,0,0,0,0,1|2,0,1]=4 379 B10R1.27 O=C(CO)Nc1cscn1 WXVL_AF00216SB2706 [0,0,0,0,0,1|2,0,1]=4 380 B10R1.27 O=C(CO)Nc1ncc[nH]1 WXVL_AF0297SB2706 [0,0,0,0,0,1|2,0,0]=3 381 B10R1.27 O=C(CO)Nc1ncc[nH]1 WXVL_AF0297SB2706 [0,0,0,0,0,1|2,0,0]=3 382 B10R1.27 O=C(CO)Nc1ncco1 WXVL_AF0235SB2706 [0,0,0,0,0,1|2,0,1]=4 383 B10R1.27 O=C(CO)Nc1ncco1 WXVL_AF0235SB2706 [0,0,0,0,0,1|2,0,1]=4 384 B10R1.27 O=C(CO)Nc1nccs1 WXVL_AF0003SB2706 [0,0,0,0,0,1|2,0,1]=4 385 B10R1.27 O=C(CO)Nc1nccs1 WXVL_AF0003SB2706 [0,0,0,0,0,1|2,0,1]=4 386 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [1,0,1,0,0,0|0,0,1]=3 387 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [1,0,1,0,0,0|0,0,1]=3 388 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [1,0,1,0,0,0|1,0,1]=4 389 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [1,0,1,0,0,0|1,0,1]=4 390 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [1,0,1,0,0,0|1,0,1]=4 391 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [1,0,1,0,0,0|1,0,1]=4 392 B7R0.4 C/C=C/C=C/C(=O)N WXVL_AK0084SB0348 [1,0,1,0,0,0|2,0,0]=4 393 B7R0.4 C/C=C/C=C/C(=O)N WXVL_AK0084SB0348 [1,0,1,0,0,0|2,0,0]=4 394 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [0,1,1,0,0,0|1,0,0]=3 395 B9R0.8 C=CCNC(=O)C(=O)CC WXVL_AK00561SB0344 [0,1,1,0,0,0|1,0,0]=3 396 B9R0.5 C/C=C/C=C/C(=O)NCC WXVL_AK00476SB0348 [0,1,1,0,0,0|1,0,0]=3 397 B9R0.5 C/C=C/C=C/C(=O)NCC WXVL_AK00476SB0348 [0,1,1,0,0,0|1,0,0]=3 398 B9R0.24 C=CC(=O)NCC(=O)NC WXVL_AK00442SB9931 [0,1,1,0,0,0|1,0,1]=4 399 B9R0.24 C=CC(=O)NCC(=O)NC WXVL_AK00442SB9931 [0,1,1,0,0,0|1,0,1]=4 400 B9R0.47 C/C=C/C=C/C(=O)N(C)C WXVL_AN0032SB0348 [0,1,1,0,0,0|2,0,0]=4 401 B9R0.47 C/C=C/C=C/C(=O)N(C)C WXVL_AN0032SB0348 [0,1,1,0,0,0|2,0,0]=4 402 B9R1.35 Cc1c[nH]c(c1)C(=O)N WXVL_AK0084SC0830 [1,1,0,0,0,0|1,0,0]=3 403 B9R1.35 Cc1c[nH]c(c1)C(=O)N WXVL_AK0084SC0830 [1,1,0,0,0,0|1,0,0]=3 404 B9R1.35 Cc1cc([nH]n1)C(=O)N WXVL_AK0084SC2215 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.35 Cc1cc([nH]n1)C(=O)N WXVL_AK0084SC2215 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.35 Cc1ccc(o1)C(=O)N WXVL_AK0084SC0005 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.35 Cc1ccc(o1)C(=O)N WXVL_AK0084SC0005 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.35 Cc1ccc(s1)C(=O)N WXVL_AK0084SC0053 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.35 Cc1ccc(s1)C(=O)N WXVL_AK0084SC0053 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.35 Cc1csc(c1)C(=O)N WXVL_AK0084SC0004 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.35 Cc1csc(c1)C(=O)N WXVL_AK0084SC0004 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.35 NC(=O)c1cc(c[nH]1)Br WXVL_AK0084SC0644 [1,1,0,0,0,0|1,0,0]=3 413 B9R1.35 NC(=O)c1cc(c[nH]1)Br WXVL_AK0084SC0644 [1,1,0,0,0,0|1,0,0]=3 414 B9R1.35 NC(=O)c1cc(c[nH]1)F WXVL_AK0084SC0334 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.35 NC(=O)c1cc(c[nH]1)F WXVL_AK0084SC0334 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.35 NC(=O)c1cc(cs1)Br WXVL_AK0084SC0188 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.35 NC(=O)c1cc(cs1)Br WXVL_AK0084SC0188 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.35 NC(=O)c1ccc(o1)Cl WXVL_AK0084SC0926 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.35 NC(=O)c1ccc(o1)Cl WXVL_AK0084SC0926 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.35 NC(=O)c1ccc(s1)Br WXVL_AK0084SC0359 [1,1,0,0,0,0|2,0,0]=4 421 B9R1.35 NC(=O)c1ccc(s1)Br WXVL_AK0084SC0359 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.35 NC(=O)c1ccc(s1)Cl WXVL_AK0084SC0067 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.35 NC(=O)c1ccc(s1)Cl WXVL_AK0084SC0067 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.35 NC(=O)c1cnc([nH]1)O WXVL_AK0084SC0498 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.35 NC(=O)c1cnc([nH]1)O WXVL_AK0084SC0498 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.41 Cc1cc[nH]c1C(=O)N WXVL_AK0084SC1315 [1,1,0,0,0,0|1,0,0]=3 427 B9R1.41 Cc1cc[nH]c1C(=O)N WXVL_AK0084SC1315 [1,1,0,0,0,0|1,0,0]=3 428 B9R1.41 Cc1ccoc1C(=O)N WXVL_AK0084SC0230 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.41 Cc1ccoc1C(=O)N WXVL_AK0084SC0230 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.41 Cc1ccsc1C(=O)N WXVL_AK0084SC0052 [1,1,0,0,0,0|2,0,0]=4 431 B9R1.41 Cc1ccsc1C(=O)N WXVL_AK0084SC0052 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.41 Cc1nc[nH]c1C(=O)N WXVL_AK0084SC0269 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.41 Cc1nc[nH]c1C(=O)N WXVL_AK0084SC0269 [1,1,0,0,0,0|2,0,0]=4 434 B9R1.41 Cn1ccnc1C(=O)N WXVL_AK0084SC0106 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.41 Cn1ccnc1C(=O)N WXVL_AK0084SC0106 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.41 Cn1cncc1C(=O)N WXVL_AK0084SC0099 [1,1,0,0,0,0|2,0,0]=4 437 B9R1.41 Cn1cncc1C(=O)N WXVL_AK0084SC0099 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.41 Cn1nccc1C(=O)N WXVL_AK0084SC0090 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.41 Cn1nccc1C(=O)N WXVL_AK0084SC0090 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.41 NC(=O)c1occc1Br WXVL_AK0084SC0241 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.41 NC(=O)c1occc1Br WXVL_AK0084SC0241 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.41 NC(=O)c1sccc1Br WXVL_AK0084SC0364 [1,1,0,0,0,0|2,0,0]=4 443 B9R1.41 NC(=O)c1sccc1Br WXVL_AK0084SC0364 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.41 NC(=O)c1sccc1Cl WXVL_AK0084SC0756 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.41 NC(=O)c1sccc1Cl WXVL_AK0084SC0756 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.41 NC(=O)c1sccc1F WXVL_AK0084SC0017 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.41 NC(=O)c1sccc1F WXVL_AK0084SC0017 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.41 NC(=O)c1sccc1I WXVL_AK0084SC1579 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.41 NC(=O)c1sccc1I WXVL_AK0084SC1579 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,1|1,0,0]=3 451 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,1|1,0,0]=3 452 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,1|0,0,1]=3 453 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,1|0,0,1]=3 454 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,1|0,0,1]=3 455 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,1|0,0,1]=3 456 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,1|0,0,1]=3 457 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,1|0,0,1]=3 458 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,1|1,0,0]=3 459 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,1|1,0,0]=3 460 B11R1.16 CCNC(=O)c1ccncn1 WXVL_AK00476SC0231 [0,1,0,0,0,1|0,0,1]=3 461 B11R1.16 CCNC(=O)c1ccncn1 WXVL_AK00476SC0231 [0,1,0,0,0,1|0,0,1]=3 462 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,1|1,0,1]=4 463 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,1|1,0,1]=4 464 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,1|1,0,1]=4 465 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,1|1,0,1]=4 466 B11R1.16 CCNC(=O)c1ncccn1 WXVL_AK00476SC0096 [0,1,0,0,0,1|0,0,1]=3 467 B11R1.16 CCNC(=O)c1ncccn1 WXVL_AK00476SC0096 [0,1,0,0,0,1|0,0,1]=3 468 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,1|2,0,0]=4 469 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,1|2,0,0]=4 470 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,1|1,0,0]=3 471 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,1|1,0,0]=3 472 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,1|2,0,0]=4 473 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,1|2,0,0]=4 474 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,1|2,0,0]=4 475 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,1|2,0,0]=4 476 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,1|2,0,0]=4 477 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,1|2,0,0]=4 478 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,1|2,0,0]=4 479 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,1|2,0,0]=4 480 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,1|2,0,0]=4 481 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,1|2,0,0]=4 482 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,1|2,0,0]=4 483 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,1|2,0,0]=4 484 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,1|2,0,0]=4 485 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,1|2,0,0]=4 486 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,1|2,0,0]=4 487 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,1|2,0,0]=4 488 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,1|1,0,1]=4 489 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,1|1,0,1]=4 490 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,1|1,0,1]=4 491 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,1|1,0,1]=4 492 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,1|1,0,1]=4 493 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,1|1,0,1]=4 494 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,1|1,0,1]=4 495 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,1|1,0,1]=4 496 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,1|1,0,1]=4 497 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,1|1,0,1]=4 498 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,1|1,0,1]=4 499 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,1|1,0,1]=4 500 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,1|1,0,1]=4 501 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,1|1,0,1]=4 502 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,1|1,0,1]=4 503 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,1|1,0,1]=4 504 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,1|1,0,1]=4 505 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,1|1,0,1]=4 506 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,1|1,0,1]=4 507 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,1|1,0,1]=4 508 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,1|1,0,1]=4 509 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,1|1,0,1]=4 510 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,1|1,0,1]=4 511 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,1|1,0,1]=4 512 B11R1.22 CNC(=O)c1ncc(cn1)Cl WXVL_AK00442SC0029 [0,1,0,0,0,1|1,0,1]=4 513 B11R1.22 CNC(=O)c1ncc(cn1)Cl WXVL_AK00442SC0029 [0,1,0,0,0,1|1,0,1]=4 514 B11R1.23 CNC(=O)C1=CC=NC(=O)C1 WXVL_AK00442SC0016 [0,1,0,0,0,1|2,0,0]=4 515 B11R1.23 CNC(=O)C1=CC=NC(=O)C1 WXVL_AK00442SC0016 [0,1,0,0,0,1|2,0,0]=4 516 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,1|2,0,0]=4 517 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,1|2,0,0]=4 518 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,1|1,0,1]=4 519 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,1|1,0,1]=4 520 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,1|1,0,1]=4 521 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,1|1,0,1]=4 522 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,1|1,0,1]=4 523 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,1|1,0,1]=4 524 B11R1.23 CNC(=O)c1cc(ncn1)Cl WXVL_AK00442SC0775 [0,1,0,0,0,1|1,0,1]=4 525 B11R1.23 CNC(=O)c1cc(ncn1)Cl WXVL_AK00442SC0775 [0,1,0,0,0,1|1,0,1]=4 526 B11R1.23 CNC(=O)c1cc(ncn1)O WXVL_AK00442SC0001 [0,1,0,0,0,1|1,0,1]=4 527 B11R1.23 CNC(=O)c1cc(ncn1)O WXVL_AK00442SC0001 [0,1,0,0,0,1|1,0,1]=4 528 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,1|1,0,1]=4 529 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,1|1,0,1]=4 530 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,1|2,0,0]=4 531 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,1|2,0,0]=4 532 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,1|2,0,0]=4 533 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,1|2,0,0]=4 534 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,1|2,0,0]=4 535 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,1|2,0,0]=4 536 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,1|2,0,0]=4 537 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,1|2,0,0]=4 538 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,1|2,0,0]=4 539 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,1|2,0,0]=4 540 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,1|2,0,0]=4 541 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,1|2,0,0]=4 542 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,1|1,0,1]=4 543 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,1|1,0,1]=4 544 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,1|1,0,1]=4 545 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,1|1,0,1]=4 546 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,1|1,0,1]=4 547 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,1|1,0,1]=4 548 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,1|2,0,0]=4 549 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,1|2,0,0]=4 550 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,1|2,0,0]=4 551 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,1|2,0,0]=4 552 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,1|2,0,0]=4 553 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,1|2,0,0]=4 554 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,1|2,0,0]=4 555 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,1|2,0,0]=4 556 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,1|2,0,0]=4 557 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,1|2,0,0]=4 558 B11R1.23 CNC(=O)c1ccnc(n1)C WXVL_AK00442SC0296 [0,1,0,0,0,1|1,0,1]=4 559 B11R1.23 CNC(=O)c1ccnc(n1)C WXVL_AK00442SC0296 [0,1,0,0,0,1|1,0,1]=4 560 B11R1.23 CNC(=O)c1ccnc(n1)Cl WXVL_AK00442SC0392 [0,1,0,0,0,1|1,0,1]=4 561 B11R1.23 CNC(=O)c1ccnc(n1)Cl WXVL_AK00442SC0392 [0,1,0,0,0,1|1,0,1]=4 562 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,1|1,0,1]=4 563 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,1|1,0,1]=4 564 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,1|1,0,1]=4 565 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,1|1,0,1]=4 566 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,1|1,0,1]=4 567 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,1|1,0,1]=4 568 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,1|1,0,1]=4 569 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,1|1,0,1]=4 570 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,1|1,0,1]=4 571 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,1|1,0,1]=4 572 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,1|1,0,1]=4 573 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,1|1,0,1]=4 574 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,1|2,0,0]=4 575 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,1|2,0,0]=4 576 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,1|1,0,1]=4 577 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,1|1,0,1]=4 578 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,1|1,0,1]=4 579 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,1|1,0,1]=4 580 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,1|1,0,1]=4 581 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,1|1,0,1]=4 582 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,1|2,0,0]=4 583 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,1|2,0,0]=4 584 B11R1.36 CN(C)C(=O)c1ccncn1 WXVL_AN0032SC0231 [0,1,0,0,0,1|1,0,1]=4 585 B11R1.36 CN(C)C(=O)c1ccncn1 WXVL_AN0032SC0231 [0,1,0,0,0,1|1,0,1]=4 586 B11R1.36 CN(C)C(=O)c1ncccn1 WXVL_AN0032SC0096 [0,1,0,0,0,1|1,0,1]=4 587 B11R1.36 CN(C)C(=O)c1ncccn1 WXVL_AN0032SC0096 [0,1,0,0,0,1|1,0,1]=4 588 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,1|2,0,0]=4 589 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,1|2,0,0]=4 590 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,1|2,0,0]=4 591 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,1|2,0,0]=4 592 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,1|2,0,0]=4 593 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,1|2,0,0]=4 594 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,1|2,0,0]=4 595 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,1|2,0,0]=4 596 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,1|2,0,0]=4 597 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,1|2,0,0]=4 598 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,1|2,0,0]=4 599 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,1|2,0,0]=4 600 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,1|2,0,0]=4 601 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,1|2,0,0]=4 602 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,1|1,0,1]=4 603 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,1|1,0,1]=4 604 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,1|1,0,1]=4 605 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,1|1,0,1]=4 606 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,1|1,0,1]=4 607 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,1|1,0,1]=4 608 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,1|1,0,1]=4 609 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,1|1,0,1]=4 610 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,1|1,0,1]=4 611 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,1|1,0,1]=4 612 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,1|2,0,0]=4 613 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,1|2,0,0]=4 614 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,1|2,0,0]=4 615 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,1|2,0,0]=4 616 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,1|2,0,0]=4 617 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,1|2,0,0]=4 618 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,1|2,0,0]=4 619 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,1|2,0,0]=4 620 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,1|1,0,1]=4 621 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,1|1,0,1]=4 622 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,1|1,0,1]=4 623 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,1|1,0,1]=4 624 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,1|1,0,1]=4 625 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,1|1,0,1]=4 626 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,1|1,0,1]=4 627 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,1|1,0,1]=4 628 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,1|1,0,1]=4 629 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,1|1,0,1]=4 630 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,1|1,0,1]=4 631 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,1|1,0,1]=4 632 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,1|1,0,1]=4 633 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,1|1,0,1]=4 634 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,1|1,0,1]=4 635 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,1|1,0,1]=4 636 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,1|1,0,1]=4 637 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,1|1,0,1]=4 638 B11R1.30 C#CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB3070 [0,1,0,0,0,1|1,0,1]=4 639 B11R1.30 C#CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB3070 [0,1,0,0,0,1|1,0,1]=4 640 B11R1.30 C#CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB3070 [0,1,0,0,0,1|1,0,1]=4 641 B11R1.30 C#CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB3070 [0,1,0,0,0,1|1,0,1]=4 642 B11R1.30 C#CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB3070 [0,1,0,0,0,1|1,0,1]=4 643 B11R1.30 C#CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB3070 [0,1,0,0,0,1|1,0,1]=4 644 B11R1.30 C/C=C/C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0340 [0,1,0,0,0,1|1,0,1]=4 645 B11R1.30 C/C=C/C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0340 [0,1,0,0,0,1|1,0,1]=4 646 B11R1.30 C/C=C/C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0340 [0,1,0,0,0,1|1,0,1]=4 647 B11R1.30 C/C=C/C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0340 [0,1,0,0,0,1|1,0,1]=4 648 B11R1.30 C/C=C/C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0340 [0,1,0,0,0,1|1,0,1]=4 649 B11R1.30 C/C=C/C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0340 [0,1,0,0,0,1|1,0,1]=4 650 B11R1.30 C=CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB2732 [0,1,0,0,0,1|1,0,1]=4 651 B11R1.30 C=CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB2732 [0,1,0,0,0,1|1,0,1]=4 652 B11R1.30 C=CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB2732 [0,1,0,0,0,1|1,0,1]=4 653 B11R1.30 C=CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB2732 [0,1,0,0,0,1|1,0,1]=4 654 B11R1.30 C=CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB2732 [0,1,0,0,0,1|1,0,1]=4 655 B11R1.30 C=CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB2732 [0,1,0,0,0,1|1,0,1]=4 656 B11R1.30 CC#CC(=O)Nc1ccn[nH]1 WXVL_AF0122SB1240 [0,1,0,0,0,1|1,0,1]=4 657 B11R1.30 CC#CC(=O)Nc1ccn[nH]1 WXVL_AF0122SB1240 [0,1,0,0,0,1|1,0,1]=4 658 B11R1.30 CC#CC(=O)Nc1cnc[nH]1 WXVL_AF00103SB1240 [0,1,0,0,0,1|1,0,1]=4 659 B11R1.30 CC#CC(=O)Nc1cnc[nH]1 WXVL_AF00103SB1240 [0,1,0,0,0,1|1,0,1]=4 660 B11R1.30 CC#CC(=O)Nc1ncc[nH]1 WXVL_AF0297SB1240 [0,1,0,0,0,1|1,0,1]=4 661 B11R1.30 CC#CC(=O)Nc1ncc[nH]1 WXVL_AF0297SB1240 [0,1,0,0,0,1|1,0,1]=4 662 B11R1.30 CCCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0073 [0,1,0,0,0,1|1,0,1]=4 663 B11R1.30 CCCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0073 [0,1,0,0,0,1|1,0,1]=4 664 B11R1.30 CCCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0073 [0,1,0,0,0,1|1,0,0]=3 665 B11R1.30 CCCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0073 [0,1,0,0,0,1|1,0,0]=3 666 B11R1.30 CCCC(=O)Nc1ccno1 WXVL_AF0588SB0073 [0,1,0,0,0,1|2,0,0]=4 667 B11R1.30 CCCC(=O)Nc1ccno1 WXVL_AF0588SB0073 [0,1,0,0,0,1|2,0,0]=4 668 B11R1.30 CCCC(=O)Nc1ccns1 WXVL_AF00325SB0073 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.30 CCCC(=O)Nc1ccns1 WXVL_AF00325SB0073 [0,1,0,0,0,1|2,0,0]=4 670 B11R1.30 CCCC(=O)Nc1ccon1 WXVL_AF0028SB0073 [0,1,0,0,0,1|1,0,1]=4 671 B11R1.30 CCCC(=O)Nc1ccon1 WXVL_AF0028SB0073 [0,1,0,0,0,1|1,0,1]=4 672 B11R1.30 CCCC(=O)Nc1ccsc1 WXVL_AF00105SB0073 [0,1,0,0,0,1|2,0,0]=4 673 B11R1.30 CCCC(=O)Nc1ccsc1 WXVL_AF00105SB0073 [0,1,0,0,0,1|2,0,0]=4 674 B11R1.30 CCCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0073 [0,1,0,0,0,1|1,0,0]=3 675 B11R1.30 CCCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0073 [0,1,0,0,0,1|1,0,0]=3 676 B11R1.30 CCCC(=O)Nc1cncs1 WXVL_AF0724SB0073 [0,1,0,0,0,1|2,0,0]=4 677 B11R1.30 CCCC(=O)Nc1cncs1 WXVL_AF0724SB0073 [0,1,0,0,0,1|2,0,0]=4 678 B11R1.30 CCCC(=O)Nc1cscn1 WXVL_AF00216SB0073 [0,1,0,0,0,1|1,0,1]=4 679 B11R1.30 CCCC(=O)Nc1cscn1 WXVL_AF00216SB0073 [0,1,0,0,0,1|1,0,1]=4 680 B11R1.30 CCCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0073 [0,1,0,0,0,1|1,0,0]=3 681 B11R1.30 CCCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0073 [0,1,0,0,0,1|1,0,0]=3 682 B11R1.30 CCCC(=O)Nc1ncco1 WXVL_AF0235SB0073 [0,1,0,0,0,1|1,0,1]=4 683 B11R1.30 CCCC(=O)Nc1ncco1 WXVL_AF0235SB0073 [0,1,0,0,0,1|1,0,1]=4 684 B11R1.30 CCCC(=O)Nc1nccs1 WXVL_AF0003SB0073 [0,1,0,0,0,1|1,0,1]=4 685 B11R1.30 CCCC(=O)Nc1nccs1 WXVL_AF0003SB0073 [0,1,0,0,0,1|1,0,1]=4 686 B11R1.30 CCNC(=O)Cc1cccs1 WXVL_AK00476SA0018 [0,1,0,0,0,1|1,0,0]=3 687 B11R1.30 CCNC(=O)Cc1cccs1 WXVL_AK00476SA0018 [0,1,0,0,0,1|1,0,0]=3 688 B11R1.30 CCNC(=O)Cc1ccn[nH]1 WXVL_AK00476SA00008 [0,1,0,0,0,1|1,0,0]=3 689 B11R1.30 CCNC(=O)Cc1ccn[nH]1 WXVL_AK00476SA00008 [0,1,0,0,0,1|1,0,0]=3 690 B11R1.30 CCNC(=O)Cc1ccsc1 WXVL_AK00476SA0020 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.30 CCNC(=O)Cc1ccsc1 WXVL_AK00476SA0020 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.30 CCNC(=O)Cc1cscn1 WXVL_AK00476SA0012 [0,1,0,0,0,1|1,0,1]=4 693 B11R1.30 CCNC(=O)Cc1cscn1 WXVL_AK00476SA0012 [0,1,0,0,0,1|1,0,1]=4 694 B11R1.30 CCNC(=O)Cn1cccn1 WXVL_AK00476SA0030 [0,1,0,0,0,1|1,0,1]=4 695 B11R1.30 CCNC(=O)Cn1cccn1 WXVL_AK00476SA0030 [0,1,0,0,0,1|1,0,1]=4 696 B11R1.30 COCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0090 [0,1,0,0,0,1|1,0,1]=4 697 B11R1.30 COCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB0090 [0,1,0,0,0,1|1,0,1]=4 698 B11R1.30 COCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0090 [0,1,0,0,0,1|1,0,0]=3 699 B11R1.30 COCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0090 [0,1,0,0,0,1|1,0,0]=3 700 B11R1.30 COCC(=O)Nc1ccno1 WXVL_AF0588SB0090 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.30 COCC(=O)Nc1ccno1 WXVL_AF0588SB0090 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.30 COCC(=O)Nc1ccns1 WXVL_AF00325SB0090 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.30 COCC(=O)Nc1ccns1 WXVL_AF00325SB0090 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.30 COCC(=O)Nc1ccon1 WXVL_AF0028SB0090 [0,1,0,0,0,1|1,0,1]=4 705 B11R1.30 COCC(=O)Nc1ccon1 WXVL_AF0028SB0090 [0,1,0,0,0,1|1,0,1]=4 706 B11R1.30 COCC(=O)Nc1ccsc1 WXVL_AF00105SB0090 [0,1,0,0,0,1|2,0,0]=4 707 B11R1.30 COCC(=O)Nc1ccsc1 WXVL_AF00105SB0090 [0,1,0,0,0,1|2,0,0]=4 708 B11R1.30 COCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0090 [0,1,0,0,0,1|1,0,0]=3 709 B11R1.30 COCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0090 [0,1,0,0,0,1|1,0,0]=3 710 B11R1.30 COCC(=O)Nc1cncs1 WXVL_AF0724SB0090 [0,1,0,0,0,1|2,0,0]=4 711 B11R1.30 COCC(=O)Nc1cncs1 WXVL_AF0724SB0090 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.30 COCC(=O)Nc1cscn1 WXVL_AF00216SB0090 [0,1,0,0,0,1|1,0,1]=4 713 B11R1.30 COCC(=O)Nc1cscn1 WXVL_AF00216SB0090 [0,1,0,0,0,1|1,0,1]=4 714 B11R1.30 COCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0090 [0,1,0,0,0,1|1,0,0]=3 715 B11R1.30 COCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0090 [0,1,0,0,0,1|1,0,0]=3 716 B11R1.30 COCC(=O)Nc1ncco1 WXVL_AF0235SB0090 [0,1,0,0,0,1|1,0,1]=4 717 B11R1.30 COCC(=O)Nc1ncco1 WXVL_AF0235SB0090 [0,1,0,0,0,1|1,0,1]=4 718 B11R1.30 COCC(=O)Nc1nccs1 WXVL_AF0003SB0090 [0,1,0,0,0,1|1,0,1]=4 719 B11R1.30 COCC(=O)Nc1nccs1 WXVL_AF0003SB0090 [0,1,0,0,0,1|1,0,1]=4 720 B11R1.30 CSCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB1267 [0,1,0,0,0,1|1,0,1]=4 721 B11R1.30 CSCC(=O)Nc1cc[nH]n1 WXVL_AF2373SB1267 [0,1,0,0,0,1|1,0,1]=4 722 B11R1.30 CSCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB1267 [0,1,0,0,0,1|1,0,0]=3 723 B11R1.30 CSCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB1267 [0,1,0,0,0,1|1,0,0]=3 724 B11R1.30 CSCC(=O)Nc1ccno1 WXVL_AF0588SB1267 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.30 CSCC(=O)Nc1ccno1 WXVL_AF0588SB1267 [0,1,0,0,0,1|2,0,0]=4 726 B11R1.30 CSCC(=O)Nc1ccns1 WXVL_AF00325SB1267 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.30 CSCC(=O)Nc1ccns1 WXVL_AF00325SB1267 [0,1,0,0,0,1|2,0,0]=4 728 B11R1.30 CSCC(=O)Nc1ccon1 WXVL_AF0028SB1267 [0,1,0,0,0,1|1,0,1]=4 729 B11R1.30 CSCC(=O)Nc1ccon1 WXVL_AF0028SB1267 [0,1,0,0,0,1|1,0,1]=4 730 B11R1.30 CSCC(=O)Nc1ccsc1 WXVL_AF00105SB1267 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.30 CSCC(=O)Nc1ccsc1 WXVL_AF00105SB1267 [0,1,0,0,0,1|2,0,0]=4 732 B11R1.30 CSCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB1267 [0,1,0,0,0,1|1,0,0]=3 733 B11R1.30 CSCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB1267 [0,1,0,0,0,1|1,0,0]=3 734 B11R1.30 CSCC(=O)Nc1cncs1 WXVL_AF0724SB1267 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.30 CSCC(=O)Nc1cncs1 WXVL_AF0724SB1267 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.30 CSCC(=O)Nc1cscn1 WXVL_AF00216SB1267 [0,1,0,0,0,1|1,0,1]=4 737 B11R1.30 CSCC(=O)Nc1cscn1 WXVL_AF00216SB1267 [0,1,0,0,0,1|1,0,1]=4 738 B11R1.30 CSCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB1267 [0,1,0,0,0,1|1,0,0]=3 739 B11R1.30 CSCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB1267 [0,1,0,0,0,1|1,0,0]=3 740 B11R1.30 CSCC(=O)Nc1ncco1 WXVL_AF0235SB1267 [0,1,0,0,0,1|1,0,1]=4 741 B11R1.30 CSCC(=O)Nc1ncco1 WXVL_AF0235SB1267 [0,1,0,0,0,1|1,0,1]=4 742 B11R1.30 CSCC(=O)Nc1nccs1 WXVL_AF0003SB1267 [0,1,0,0,0,1|1,0,1]=4 743 B11R1.30 CSCC(=O)Nc1nccs1 WXVL_AF0003SB1267 [0,1,0,0,0,1|1,0,1]=4 744 B11R1.30 N#CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0057 [0,1,0,0,0,1|1,0,1]=4 745 B11R1.30 N#CCC(=O)Nc1ccn[nH]1 WXVL_AF0122SB0057 [0,1,0,0,0,1|1,0,1]=4 746 B11R1.30 N#CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0057 [0,1,0,0,0,1|1,0,1]=4 747 B11R1.30 N#CCC(=O)Nc1cnc[nH]1 WXVL_AF00103SB0057 [0,1,0,0,0,1|1,0,1]=4 748 B11R1.30 N#CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0057 [0,1,0,0,0,1|1,0,1]=4 749 B11R1.30 N#CCC(=O)Nc1ncc[nH]1 WXVL_AF0297SB0057 [0,1,0,0,0,1|1,0,1]=4 750 B11R1.31 CNC(=O)C(=O)c1ccco1 WXVL_AK00442SA0049 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.31 CNC(=O)C(=O)c1ccco1 WXVL_AK00442SA0049 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.31 CNC(=O)C(C)c1cccs1 WXVL_AK00442SA1203 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.31 CNC(=O)C(C)c1cccs1 WXVL_AK00442SA1203 [0,1,0,0,0,1|2,0,0]=4 754 B11R1.35 CC(=O)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0051 [0,1,0,0,0,1|1,0,1]=4 755 B11R1.35 CC(=O)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0051 [0,1,0,0,0,1|1,0,1]=4 756 B11R1.35 CC(=O)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0051 [0,1,0,0,0,1|1,0,1]=4 757 B11R1.35 CC(=O)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0051 [0,1,0,0,0,1|1,0,1]=4 758 B11R1.35 CC(=O)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0051 [0,1,0,0,0,1|1,0,1]=4 759 B11R1.35 CC(=O)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0051 [0,1,0,0,0,1|1,0,1]=4 760 B11R1.35 CC(C)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB0052 [0,1,0,0,0,1|1,0,1]=4 761 B11R1.35 CC(C)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB0052 [0,1,0,0,0,1|1,0,1]=4 762 B11R1.35 CC(C)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0052 [0,1,0,0,0,1|1,0,0]=3 763 B11R1.35 CC(C)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB0052 [0,1,0,0,0,1|1,0,0]=3 764 B11R1.35 CC(C)C(=O)Nc1ccno1 WXVL_AF0588SB0052 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.35 CC(C)C(=O)Nc1ccno1 WXVL_AF0588SB0052 [0,1,0,0,0,1|2,0,0]=4 766 B11R1.35 CC(C)C(=O)Nc1ccns1 WXVL_AF00325SB0052 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.35 CC(C)C(=O)Nc1ccns1 WXVL_AF00325SB0052 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.35 CC(C)C(=O)Nc1ccon1 WXVL_AF0028SB0052 [0,1,0,0,0,1|1,0,1]=4 769 B11R1.35 CC(C)C(=O)Nc1ccon1 WXVL_AF0028SB0052 [0,1,0,0,0,1|1,0,1]=4 770 B11R1.35 CC(C)C(=O)Nc1ccsc1 WXVL_AF00105SB0052 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.35 CC(C)C(=O)Nc1ccsc1 WXVL_AF00105SB0052 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.35 CC(C)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0052 [0,1,0,0,0,1|1,0,0]=3 773 B11R1.35 CC(C)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB0052 [0,1,0,0,0,1|1,0,0]=3 774 B11R1.35 CC(C)C(=O)Nc1cncs1 WXVL_AF0724SB0052 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.35 CC(C)C(=O)Nc1cncs1 WXVL_AF0724SB0052 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.35 CC(C)C(=O)Nc1cscn1 WXVL_AF00216SB0052 [0,1,0,0,0,1|1,0,1]=4 777 B11R1.35 CC(C)C(=O)Nc1cscn1 WXVL_AF00216SB0052 [0,1,0,0,0,1|1,0,1]=4 778 B11R1.35 CC(C)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0052 [0,1,0,0,0,1|1,0,0]=3 779 B11R1.35 CC(C)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB0052 [0,1,0,0,0,1|1,0,0]=3 780 B11R1.35 CC(C)C(=O)Nc1ncco1 WXVL_AF0235SB0052 [0,1,0,0,0,1|1,0,1]=4 781 B11R1.35 CC(C)C(=O)Nc1ncco1 WXVL_AF0235SB0052 [0,1,0,0,0,1|1,0,1]=4 782 B11R1.35 CC(C)C(=O)Nc1nccs1 WXVL_AF0003SB0052 [0,1,0,0,0,1|1,0,1]=4 783 B11R1.35 CC(C)C(=O)Nc1nccs1 WXVL_AF0003SB0052 [0,1,0,0,0,1|1,0,1]=4 784 B11R1.35 CC(S)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB2708 [0,1,0,0,0,1|1,0,1]=4 785 B11R1.35 CC(S)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB2708 [0,1,0,0,0,1|1,0,1]=4 786 B11R1.35 CC(S)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB2708 [0,1,0,0,0,1|1,0,0]=3 787 B11R1.35 CC(S)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB2708 [0,1,0,0,0,1|1,0,0]=3 788 B11R1.35 CC(S)C(=O)Nc1ccno1 WXVL_AF0588SB2708 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.35 CC(S)C(=O)Nc1ccno1 WXVL_AF0588SB2708 [0,1,0,0,0,1|2,0,0]=4 790 B11R1.35 CC(S)C(=O)Nc1ccns1 WXVL_AF00325SB2708 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.35 CC(S)C(=O)Nc1ccns1 WXVL_AF00325SB2708 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.35 CC(S)C(=O)Nc1ccon1 WXVL_AF0028SB2708 [0,1,0,0,0,1|1,0,1]=4 793 B11R1.35 CC(S)C(=O)Nc1ccon1 WXVL_AF0028SB2708 [0,1,0,0,0,1|1,0,1]=4 794 B11R1.35 CC(S)C(=O)Nc1ccsc1 WXVL_AF00105SB2708 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.35 CC(S)C(=O)Nc1ccsc1 WXVL_AF00105SB2708 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.35 CC(S)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB2708 [0,1,0,0,0,1|1,0,0]=3 797 B11R1.35 CC(S)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB2708 [0,1,0,0,0,1|1,0,0]=3 798 B11R1.35 CC(S)C(=O)Nc1cncs1 WXVL_AF0724SB2708 [0,1,0,0,0,1|2,0,0]=4 799 B11R1.35 CC(S)C(=O)Nc1cncs1 WXVL_AF0724SB2708 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.35 CC(S)C(=O)Nc1cscn1 WXVL_AF00216SB2708 [0,1,0,0,0,1|1,0,1]=4 801 B11R1.35 CC(S)C(=O)Nc1cscn1 WXVL_AF00216SB2708 [0,1,0,0,0,1|1,0,1]=4 802 B11R1.35 CC(S)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB2708 [0,1,0,0,0,1|1,0,0]=3 803 B11R1.35 CC(S)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB2708 [0,1,0,0,0,1|1,0,0]=3 804 B11R1.35 CC(S)C(=O)Nc1ncco1 WXVL_AF0235SB2708 [0,1,0,0,0,1|1,0,1]=4 805 B11R1.35 CC(S)C(=O)Nc1ncco1 WXVL_AF0235SB2708 [0,1,0,0,0,1|1,0,1]=4 806 B11R1.35 CC(S)C(=O)Nc1nccs1 WXVL_AF0003SB2708 [0,1,0,0,0,1|1,0,1]=4 807 B11R1.35 CC(S)C(=O)Nc1nccs1 WXVL_AF0003SB2708 [0,1,0,0,0,1|1,0,1]=4 808 B11R1.35 CN(C)C(=O)Cc1cccs1 WXVL_AN0032SA0018 [0,1,0,0,0,1|2,0,0]=4 809 B11R1.35 CN(C)C(=O)Cc1cccs1 WXVL_AN0032SA0018 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.35 CN(C)C(=O)Cc1ccn[nH]1 WXVL_AN0032SA00008 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.35 CN(C)C(=O)Cc1ccn[nH]1 WXVL_AN0032SA00008 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.35 C[C@@H](O)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB1085 [0,1,0,0,0,1|1,0,1]=4 813 B11R1.35 C[C@@H](O)C(=O)Nc1cc[nH]n1 WXVL_AF2373SB1085 [0,1,0,0,0,1|1,0,1]=4 814 B11R1.35 C[C@@H](O)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB1085 [0,1,0,0,0,1|1,0,0]=3 815 B11R1.35 C[C@@H](O)C(=O)Nc1ccn[nH]1 WXVL_AF0122SB1085 [0,1,0,0,0,1|1,0,0]=3 816 B11R1.35 C[C@@H](O)C(=O)Nc1ccno1 WXVL_AF0588SB1085 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.35 C[C@@H](O)C(=O)Nc1ccno1 WXVL_AF0588SB1085 [0,1,0,0,0,1|2,0,0]=4 818 B11R1.35 C[C@@H](O)C(=O)Nc1ccns1 WXVL_AF00325SB1085 [0,1,0,0,0,1|2,0,0]=4 819 B11R1.35 C[C@@H](O)C(=O)Nc1ccns1 WXVL_AF00325SB1085 [0,1,0,0,0,1|2,0,0]=4 820 B11R1.35 C[C@@H](O)C(=O)Nc1ccon1 WXVL_AF0028SB1085 [0,1,0,0,0,1|1,0,1]=4 821 B11R1.35 C[C@@H](O)C(=O)Nc1ccon1 WXVL_AF0028SB1085 [0,1,0,0,0,1|1,0,1]=4 822 B11R1.35 C[C@@H](O)C(=O)Nc1ccsc1 WXVL_AF00105SB1085 [0,1,0,0,0,1|2,0,0]=4 823 B11R1.35 C[C@@H](O)C(=O)Nc1ccsc1 WXVL_AF00105SB1085 [0,1,0,0,0,1|2,0,0]=4 824 B11R1.35 C[C@@H](O)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB1085 [0,1,0,0,0,1|1,0,0]=3 825 B11R1.35 C[C@@H](O)C(=O)Nc1cnc[nH]1 WXVL_AF00103SB1085 [0,1,0,0,0,1|1,0,0]=3 826 B11R1.35 C[C@@H](O)C(=O)Nc1cncs1 WXVL_AF0724SB1085 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.35 C[C@@H](O)C(=O)Nc1cncs1 WXVL_AF0724SB1085 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.35 C[C@@H](O)C(=O)Nc1cscn1 WXVL_AF00216SB1085 [0,1,0,0,0,1|1,0,1]=4 829 B11R1.35 C[C@@H](O)C(=O)Nc1cscn1 WXVL_AF00216SB1085 [0,1,0,0,0,1|1,0,1]=4 830 B11R1.35 C[C@@H](O)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB1085 [0,1,0,0,0,1|1,0,0]=3 831 B11R1.35 C[C@@H](O)C(=O)Nc1ncc[nH]1 WXVL_AF0297SB1085 [0,1,0,0,0,1|1,0,0]=3 832 B11R1.35 C[C@@H](O)C(=O)Nc1ncco1 WXVL_AF0235SB1085 [0,1,0,0,0,1|1,0,1]=4 833 B11R1.35 C[C@@H](O)C(=O)Nc1ncco1 WXVL_AF0235SB1085 [0,1,0,0,0,1|1,0,1]=4 834 B11R1.35 C[C@@H](O)C(=O)Nc1nccs1 WXVL_AF0003SB1085 [0,1,0,0,0,1|1,0,1]=4 835 B11R1.35 C[C@@H](O)C(=O)Nc1nccs1 WXVL_AF0003SB1085 [0,1,0,0,0,1|1,0,1]=4 836 B11R1.35 O=C(Nc1ccn[nH]1)C(F)F WXVL_AF0122SB0079 [0,1,0,0,0,1|2,0,0]=4 837 B11R1.35 O=C(Nc1ccn[nH]1)C(F)F WXVL_AF0122SB0079 [0,1,0,0,0,1|2,0,0]=4 838 B11R1.35 O=C(Nc1cnc[nH]1)C(F)F WXVL_AF00103SB0079 [0,1,0,0,0,1|2,0,0]=4 839 B11R1.35 O=C(Nc1cnc[nH]1)C(F)F WXVL_AF00103SB0079 [0,1,0,0,0,1|2,0,0]=4 840 B11R1.35 O=C(Nc1ncc[nH]1)C(F)F WXVL_AF0297SB0079 [0,1,0,0,0,1|2,0,0]=4 841 B11R1.35 O=C(Nc1ncc[nH]1)C(F)F WXVL_AF0297SB0079 [0,1,0,0,0,1|2,0,0]=4 842 B11R1.39 CCC(=O)Nc1cc([nH]n1)C WXVL_AF2553SB0064 [0,1,0,0,0,1|1,0,1]=4 843 B11R1.39 CCC(=O)Nc1cc([nH]n1)C WXVL_AF2553SB0064 [0,1,0,0,0,1|1,0,1]=4 844 B11R1.39 CCC(=O)Nc1cc(n[nH]1)Br WXVL_AF4634SB0064 [0,1,0,0,0,1|1,0,0]=3 845 B11R1.39 CCC(=O)Nc1cc(n[nH]1)Br WXVL_AF4634SB0064 [0,1,0,0,0,1|1,0,0]=3 846 B11R1.39 CCC(=O)Nc1cc(n[nH]1)C WXVL_AF0238SB0064 [0,1,0,0,0,1|1,0,0]=3 847 B11R1.39 CCC(=O)Nc1cc(n[nH]1)C WXVL_AF0238SB0064 [0,1,0,0,0,1|1,0,0]=3 848 B11R1.39 CCC(=O)Nc1cc(n[nH]1)O WXVL_AF0232SB0064 [0,1,0,0,0,1|1,0,0]=3 849 B11R1.39 CCC(=O)Nc1cc(n[nH]1)O WXVL_AF0232SB0064 [0,1,0,0,0,1|1,0,0]=3 850 B11R1.39 CCC(=O)Nc1cc(no1)C WXVL_AF0001SB0064 [0,1,0,0,0,1|2,0,0]=4 851 B11R1.39 CCC(=O)Nc1cc(no1)C WXVL_AF0001SB0064 [0,1,0,0,0,1|2,0,0]=4 852 B11R1.39 CCC(=O)Nc1cc(ns1)C WXVL_AF00073SB0064 [0,1,0,0,0,1|2,0,0]=4 853 B11R1.39 CCC(=O)Nc1cc(ns1)C WXVL_AF00073SB0064 [0,1,0,0,0,1|2,0,0]=4 854 B11R1.39 CCC(=O)Nc1cc(on1)C WXVL_AF0002SB0064 [0,1,0,0,0,1|1,0,1]=4 855 B11R1.39 CCC(=O)Nc1cc(on1)C WXVL_AF0002SB0064 [0,1,0,0,0,1|1,0,1]=4 856 B11R1.39 CCC(=O)Nc1ccn(n1)C WXVL_AF0044SB0064 [0,1,0,0,0,1|1,0,1]=4 857 B11R1.39 CCC(=O)Nc1ccn(n1)C WXVL_AF0044SB0064 [0,1,0,0,0,1|1,0,1]=4 858 B11R1.39 CCC(=O)Nc1cn(cn1)C WXVL_AF0086SB0064 [0,1,0,0,0,1|1,0,1]=4 859 B11R1.39 CCC(=O)Nc1cn(cn1)C WXVL_AF0086SB0064 [0,1,0,0,0,1|1,0,1]=4 860 B11R1.39 CCC(=O)Nc1cnc(s1)C WXVL_AF1241SB0064 [0,1,0,0,0,1|2,0,0]=4 861 B11R1.39 CCC(=O)Nc1cnc(s1)C WXVL_AF1241SB0064 [0,1,0,0,0,1|2,0,0]=4 862 B11R1.39 CCC(=O)Nc1csc(c1)Br WXVL_AF00144SB0064 [0,1,0,0,0,1|2,0,0]=4 863 B11R1.39 CCC(=O)Nc1csc(c1)Br WXVL_AF00144SB0064 [0,1,0,0,0,1|2,0,0]=4 864 B11R1.39 CCC(=O)Nc1csc(n1)C WXVL_AF00271SB0064 [0,1,0,0,0,1|1,0,1]=4 865 B11R1.39 CCC(=O)Nc1csc(n1)C WXVL_AF00271SB0064 [0,1,0,0,0,1|1,0,1]=4 866 B11R1.39 CCC(=O)Nc1nc(co1)C WXVL_AF0249SB0064 [0,1,0,0,0,1|1,0,1]=4 867 B11R1.39 CCC(=O)Nc1nc(co1)C WXVL_AF0249SB0064 [0,1,0,0,0,1|1,0,1]=4 868 B11R1.39 CCC(=O)Nc1nc(cs1)Br WXVL_AF3498SB0064 [0,1,0,0,0,1|1,0,1]=4 869 B11R1.39 CCC(=O)Nc1nc(cs1)Br WXVL_AF3498SB0064 [0,1,0,0,0,1|1,0,1]=4 870 B11R1.39 CCC(=O)Nc1nc(cs1)C WXVL_AF0004SB0064 [0,1,0,0,0,1|1,0,1]=4 871 B11R1.39 CCC(=O)Nc1nc(cs1)C WXVL_AF0004SB0064 [0,1,0,0,0,1|1,0,1]=4 872 B11R1.39 CCC(=O)Nc1nc(cs1)O WXVL_AF3701SB0064 [0,1,0,0,0,1|1,0,1]=4 873 B11R1.39 CCC(=O)Nc1nc(cs1)O WXVL_AF3701SB0064 [0,1,0,0,0,1|1,0,1]=4 874 B11R1.39 CCC(=O)Nc1ncc(s1)Br WXVL_AF2420SB0064 [0,1,0,0,0,1|1,0,1]=4 875 B11R1.39 CCC(=O)Nc1ncc(s1)Br WXVL_AF2420SB0064 [0,1,0,0,0,1|1,0,1]=4 876 B11R1.39 CCC(=O)Nc1ncc(s1)C WXVL_AF2555SB0064 [0,1,0,0,0,1|1,0,1]=4 877 B11R1.39 CCC(=O)Nc1ncc(s1)C WXVL_AF2555SB0064 [0,1,0,0,0,1|1,0,1]=4 878 B11R1.39 CCC(=O)Nc1ncc(s1)F WXVL_AF00078SB0064 [0,1,0,0,0,1|1,0,1]=4 879 B11R1.39 CCC(=O)Nc1ncc(s1)F WXVL_AF00078SB0064 [0,1,0,0,0,1|1,0,1]=4 880 B11R1.39 CNC(=O)Cc1cc(cs1)Br WXVL_AK00442SA0181 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.39 CNC(=O)Cc1cc(cs1)Br WXVL_AK00442SA0181 [0,1,0,0,0,1|2,0,0]=4 882 B11R1.39 CNC(=O)Cc1ccc(s1)Cl WXVL_AK00442SA0043 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.39 CNC(=O)Cc1ccc(s1)Cl WXVL_AK00442SA0043 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.39 Cc1cc([nH]n1)NC(=O)CO WXVL_AF0238SB2706 [0,1,0,0,0,1|2,0,0]=4 885 B11R1.39 Cc1cc([nH]n1)NC(=O)CO WXVL_AF0238SB2706 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.39 O=C(CO)Nc1cc(n[nH]1)Br WXVL_AF4634SB2706 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.39 O=C(CO)Nc1cc(n[nH]1)Br WXVL_AF4634SB2706 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.39 O=C(CO)Nc1cc(n[nH]1)O WXVL_AF0232SB2706 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.39 O=C(CO)Nc1cc(n[nH]1)O WXVL_AF0232SB2706 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.136 CCS(=O)(=O)Nc1ccn[nH]1 WXVL_AF0122HU0028 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.136 CCS(=O)(=O)Nc1ccn[nH]1 WXVL_AF0122HU0028 [0,1,0,0,0,1|2,0,0]=4 892 B11R1.136 CCS(=O)(=O)Nc1cnc[nH]1 WXVL_AF00103HU0028 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.136 CCS(=O)(=O)Nc1cnc[nH]1 WXVL_AF00103HU0028 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.136 CCS(=O)(=O)Nc1ncc[nH]1 WXVL_AF0297HU0028 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.136 CCS(=O)(=O)Nc1ncc[nH]1 WXVL_AF0297HU0028 [0,1,0,0,0,1|2,0,0]=4 896 B11R1.228 CCC(=O)Nc1[nH]cnc1C WXVL_AF00188SB0064 [0,1,0,0,0,1|1,0,0]=3 897 B11R1.228 CCC(=O)Nc1[nH]cnc1C WXVL_AF00188SB0064 [0,1,0,0,0,1|1,0,0]=3 898 B11R1.228 CCC(=O)Nc1[nH]ncc1Br WXVL_AF0131SB0064 [0,1,0,0,0,1|1,0,0]=3 899 B11R1.228 CCC(=O)Nc1[nH]ncc1Br WXVL_AF0131SB0064 [0,1,0,0,0,1|1,0,0]=3 900 B11R1.228 CCC(=O)Nc1[nH]ncc1C WXVL_AF0173SB0064 [0,1,0,0,0,1|1,0,0]=3 901 B11R1.228 CCC(=O)Nc1[nH]ncc1C WXVL_AF0173SB0064 [0,1,0,0,0,1|1,0,0]=3 902 B11R1.228 CCC(=O)Nc1[nH]ncc1I WXVL_AF0239SB0064 [0,1,0,0,0,1|1,0,0]=3 903 B11R1.228 CCC(=O)Nc1[nH]ncc1I WXVL_AF0239SB0064 [0,1,0,0,0,1|1,0,0]=3 904 B11R1.228 CCC(=O)Nc1ccnn1C WXVL_AF0198SB0064 [0,1,0,0,0,1|1,0,0]=3 905 B11R1.228 CCC(=O)Nc1ccnn1C WXVL_AF0198SB0064 [0,1,0,0,0,1|1,0,0]=3 906 B11R1.228 CCC(=O)Nc1cnnn1C WXVL_AF1718SB0064 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.228 CCC(=O)Nc1cnnn1C WXVL_AF1718SB0064 [0,1,0,0,0,1|2,0,0]=4 908 B11R1.228 CCC(=O)Nc1ncnn1C WXVL_AF0083SB0064 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.228 CCC(=O)Nc1ncnn1C WXVL_AF0083SB0064 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.228 Cc1cn[nH]c1NC(=O)CO WXVL_AF0173SB2706 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.228 Cc1cn[nH]c1NC(=O)CO WXVL_AF0173SB2706 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.228 Cc1nc[nH]c1NC(=O)CO WXVL_AF00188SB2706 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.228 Cc1nc[nH]c1NC(=O)CO WXVL_AF00188SB2706 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.228 Cn1nccc1NC(=O)CO WXVL_AF0198SB2706 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.228 Cn1nccc1NC(=O)CO WXVL_AF0198SB2706 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.228 O=C(CO)Nc1[nH]ncc1Br WXVL_AF0131SB2706 [0,1,0,0,0,1|2,0,0]=4 917 B11R1.228 O=C(CO)Nc1[nH]ncc1Br WXVL_AF0131SB2706 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.228 O=C(CO)Nc1[nH]ncc1I WXVL_AF0239SB2706 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.228 O=C(CO)Nc1[nH]ncc1I WXVL_AF0239SB2706 [0,1,0,0,0,1|2,0,0]=4 920 B11R1.33 CCNS(=O)(=O)c1cccs1 WXVL_AK00476HU0005 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.33 CCNS(=O)(=O)c1cccs1 WXVL_AK00476HU0005 [0,2,0,0,0,0|2,0,0]=4 922 B11R1.15 CCNC(=O)c1c[nH]c(c1)C WXVL_AK00476SC0298 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.15 CCNC(=O)c1c[nH]c(c1)C WXVL_AK00476SC0298 [0,2,0,0,0,0|2,0,0]=4 924 B11R1.15 CCNC(=O)c1c[nH]c(n1)C WXVL_AK00476SC0009 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.15 CCNC(=O)c1c[nH]c(n1)C WXVL_AK00476SC0009 [0,2,0,0,0,0|1,0,1]=4 926 B11R1.15 CCNC(=O)c1cc([nH]n1)C WXVL_AK00476SC0267 [0,2,0,0,0,0|1,0,1]=4 927 B11R1.15 CCNC(=O)c1cc([nH]n1)C WXVL_AK00476SC0267 [0,2,0,0,0,0|1,0,1]=4 928 B11R1.15 CCNC(=O)c1cc(c[nH]1)Br WXVL_AK00476SC0644 [0,2,0,0,0,0|0,0,0]=2 929 B11R1.15 CCNC(=O)c1cc(c[nH]1)Br WXVL_AK00476SC0644 [0,2,0,0,0,0|0,0,0]=2 930 B11R1.15 CCNC(=O)c1cc(c[nH]1)C WXVL_AK00476SC0830 [0,2,0,0,0,0|0,0,0]=2 931 B11R1.15 CCNC(=O)c1cc(c[nH]1)C WXVL_AK00476SC0830 [0,2,0,0,0,0|0,0,0]=2 932 B11R1.15 CCNC(=O)c1cc(c[nH]1)F WXVL_AK00476SC0334 [0,2,0,0,0,0|0,0,0]=2 933 B11R1.15 CCNC(=O)c1cc(c[nH]1)F WXVL_AK00476SC0334 [0,2,0,0,0,0|0,0,0]=2 934 B11R1.15 CCNC(=O)c1cc(cs1)Br WXVL_AK00476SC0188 [0,2,0,0,0,0|1,0,0]=3 935 B11R1.15 CCNC(=O)c1cc(cs1)Br WXVL_AK00476SC0188 [0,2,0,0,0,0|1,0,0]=3 936 B11R1.15 CCNC(=O)c1cc(cs1)C WXVL_AK00476SC0004 [0,2,0,0,0,0|1,0,0]=3 937 B11R1.15 CCNC(=O)c1cc(cs1)C WXVL_AK00476SC0004 [0,2,0,0,0,0|1,0,0]=3 938 B11R1.15 CCNC(=O)c1cc(n[nH]1)C WXVL_AK00476SC2215 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.15 CCNC(=O)c1cc(n[nH]1)C WXVL_AK00476SC2215 [0,2,0,0,0,0|1,0,0]=3 940 B11R1.15 CCNC(=O)c1cc(no1)C WXVL_AK00476SC0089 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.15 CCNC(=O)c1cc(no1)C WXVL_AK00476SC0089 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.15 CCNC(=O)c1cc(no1)O WXVL_AK00476SC0522 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.15 CCNC(=O)c1cc(no1)O WXVL_AK00476SC0522 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.15 CCNC(=O)c1cc(on1)C WXVL_AK00476SC0101 [0,2,0,0,0,0|1,0,1]=4 945 B11R1.15 CCNC(=O)c1cc(on1)C WXVL_AK00476SC0101 [0,2,0,0,0,0|1,0,1]=4 946 B11R1.15 CCNC(=O)c1ccc(o1)C WXVL_AK00476SC0005 [0,2,0,0,0,0|1,0,0]=3 947 B11R1.15 CCNC(=O)c1ccc(o1)C WXVL_AK00476SC0005 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.15 CCNC(=O)c1ccc(o1)Cl WXVL_AK00476SC0926 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.15 CCNC(=O)c1ccc(o1)Cl WXVL_AK00476SC0926 [0,2,0,0,0,0|1,0,0]=3 950 B11R1.15 CCNC(=O)c1ccc(s1)Br WXVL_AK00476SC0359 [0,2,0,0,0,0|1,0,0]=3 951 B11R1.15 CCNC(=O)c1ccc(s1)Br WXVL_AK00476SC0359 [0,2,0,0,0,0|1,0,0]=3 952 B11R1.15 CCNC(=O)c1ccc(s1)C WXVL_AK00476SC0053 [0,2,0,0,0,0|1,0,0]=3 953 B11R1.15 CCNC(=O)c1ccc(s1)C WXVL_AK00476SC0053 [0,2,0,0,0,0|1,0,0]=3 954 B11R1.15 CCNC(=O)c1ccc(s1)Cl WXVL_AK00476SC0067 [0,2,0,0,0,0|1,0,0]=3 955 B11R1.15 CCNC(=O)c1ccc(s1)Cl WXVL_AK00476SC0067 [0,2,0,0,0,0|1,0,0]=3 956 B11R1.15 CCNC(=O)c1ccn(c1)C WXVL_AK00476SC0038 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.15 CCNC(=O)c1ccn(c1)C WXVL_AK00476SC0038 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.15 CCNC(=O)c1ccn(n1)C WXVL_AK00476SC0091 [0,2,0,0,0,0|1,0,1]=4 959 B11R1.15 CCNC(=O)c1ccn(n1)C WXVL_AK00476SC0091 [0,2,0,0,0,0|1,0,1]=4 960 B11R1.15 CCNC(=O)c1cn(cn1)C WXVL_AK00476SC0111 [0,2,0,0,0,0|1,0,1]=4 961 B11R1.15 CCNC(=O)c1cn(cn1)C WXVL_AK00476SC0111 [0,2,0,0,0,0|1,0,1]=4 962 B11R1.15 CCNC(=O)c1cnc([nH]1)O WXVL_AK00476SC0498 [0,2,0,0,0,0|1,0,0]=3 963 B11R1.15 CCNC(=O)c1cnc([nH]1)O WXVL_AK00476SC0498 [0,2,0,0,0,0|1,0,0]=3 964 B11R1.15 CCNC(=O)c1cnc(o1)Br WXVL_AK00476SC0815 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.15 CCNC(=O)c1cnc(o1)Br WXVL_AK00476SC0815 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.15 CCNC(=O)c1cnc(s1)Br WXVL_AK00476SC0723 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.15 CCNC(=O)c1cnc(s1)Br WXVL_AK00476SC0723 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.15 CCNC(=O)c1cnc(s1)C WXVL_AK00476SC0326 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.15 CCNC(=O)c1cnc(s1)C WXVL_AK00476SC0326 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.15 CCNC(=O)c1cnc(s1)Cl WXVL_AK00476SC0638 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.15 CCNC(=O)c1cnc(s1)Cl WXVL_AK00476SC0638 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.15 CCNC(=O)c1coc(n1)C WXVL_AK00476SC0086 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.15 CCNC(=O)c1coc(n1)C WXVL_AK00476SC0086 [0,2,0,0,0,0|1,0,1]=4 974 B11R1.15 CCNC(=O)c1coc(n1)Cl WXVL_AK00476SC1341 [0,2,0,0,0,0|1,0,1]=4 975 B11R1.15 CCNC(=O)c1coc(n1)Cl WXVL_AK00476SC1341 [0,2,0,0,0,0|1,0,1]=4 976 B11R1.15 CCNC(=O)c1csc(c1)Br WXVL_AK00476SC0189 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.15 CCNC(=O)c1csc(c1)Br WXVL_AK00476SC0189 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.15 CCNC(=O)c1csc(n1)C WXVL_AK00476SC0112 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.15 CCNC(=O)c1csc(n1)C WXVL_AK00476SC0112 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.15 CCNC(=O)c1csc(n1)Cl WXVL_AK00476SC0688 [0,2,0,0,0,0|1,0,1]=4 981 B11R1.15 CCNC(=O)c1csc(n1)Cl WXVL_AK00476SC0688 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.15 CCNC(=O)c1nc(cs1)Br WXVL_AK00476SC0687 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.15 CCNC(=O)c1nc(cs1)Br WXVL_AK00476SC0687 [0,2,0,0,0,0|1,0,1]=4 984 B11R1.15 CCNC(=O)c1nc(cs1)C WXVL_AK00476SC0538 [0,2,0,0,0,0|1,0,1]=4 985 B11R1.15 CCNC(=O)c1nc(cs1)C WXVL_AK00476SC0538 [0,2,0,0,0,0|1,0,1]=4 986 B11R1.15 CCNC(=O)c1ncc(s1)C WXVL_AK00476SC0031 [0,2,0,0,0,0|1,0,1]=4 987 B11R1.15 CCNC(=O)c1ncc(s1)C WXVL_AK00476SC0031 [0,2,0,0,0,0|1,0,1]=4 988 B11R1.29 C=CCNC(=O)c1ccco1 WXVL_AK00561SC0049 [0,2,0,0,0,0|1,0,1]=4 989 B11R1.29 C=CCNC(=O)c1ccco1 WXVL_AK00561SC0049 [0,2,0,0,0,0|1,0,1]=4 990 B11R1.29 C=CCNC(=O)c1cccs1 WXVL_AK00561SC0051 [0,2,0,0,0,0|1,0,1]=4 991 B11R1.29 C=CCNC(=O)c1cccs1 WXVL_AK00561SC0051 [0,2,0,0,0,0|1,0,1]=4 992 B11R1.29 C=CCNC(=O)c1cnc[nH]1 WXVL_AK00561SC0247 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.29 C=CCNC(=O)c1cnc[nH]1 WXVL_AK00561SC0247 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.29 CCCNC(=O)c1c[nH]cn1 WXVL_AK00504SC0074 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.29 CCCNC(=O)c1c[nH]cn1 WXVL_AK00504SC0074 [0,2,0,0,0,0|1,0,1]=4 996 B11R1.29 CCCNC(=O)c1cc[nH]c1 WXVL_AK00504SC0013 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.29 CCCNC(=O)c1cc[nH]c1 WXVL_AK00504SC0013 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.29 CCCNC(=O)c1cc[nH]n1 WXVL_AK00504SC0003 [0,2,0,0,0,0|1,0,1]=4 999 B11R1.29 CCCNC(=O)c1cc[nH]n1 WXVL_AK00504SC0003 [0,2,0,0,0,0|1,0,1]=4 1000 B11R1.29 CCCNC(=O)c1ccco1 WXVL_AK00504SC0049 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.29 CCCNC(=O)c1ccco1 WXVL_AK00504SC0049 [0,2,0,0,0,0|1,0,0]=3 1002 B11R1.29 CCCNC(=O)c1cccs1 WXVL_AK00504SC0051 [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.29 CCCNC(=O)c1cccs1 WXVL_AK00504SC0051 [0,2,0,0,0,0|1,0,0]=3 1004 B11R1.29 CCCNC(=O)c1ccno1 WXVL_AK00504SC0080 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.29 CCCNC(=O)c1ccno1 WXVL_AK00504SC0080 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.29 CCCNC(=O)c1ccns1 WXVL_AK00504SC0027 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.29 CCCNC(=O)c1ccns1 WXVL_AK00504SC0027 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.29 CCCNC(=O)c1ccoc1 WXVL_AK00504SC0050 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.29 CCCNC(=O)c1ccoc1 WXVL_AK00504SC0050 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.29 CCCNC(=O)c1ccon1 WXVL_AK00504SC0116 [0,2,0,0,0,0|1,0,1]=4 1011 B11R1.29 CCCNC(=O)c1ccon1 WXVL_AK00504SC0116 [0,2,0,0,0,0|1,0,1]=4 1012 B11R1.29 CCCNC(=O)c1ccsc1 WXVL_AK00504SC0054 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.29 CCCNC(=O)c1ccsc1 WXVL_AK00504SC0054 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.29 CCCNC(=O)c1ccsn1 WXVL_AK00504SC0764 [0,2,0,0,0,0|1,0,1]=4 1015 B11R1.29 CCCNC(=O)c1ccsn1 WXVL_AK00504SC0764 [0,2,0,0,0,0|1,0,1]=4 1016 B11R1.29 CCCNC(=O)c1cnc[nH]1 WXVL_AK00504SC0247 [0,2,0,0,0,0|1,0,0]=3 1017 B11R1.29 CCCNC(=O)c1cnc[nH]1 WXVL_AK00504SC0247 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.29 CCCNC(=O)c1cnco1 WXVL_AK00504SC0018 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.29 CCCNC(=O)c1cnco1 WXVL_AK00504SC0018 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.29 CCCNC(=O)c1cncs1 WXVL_AK00504SC0113 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.29 CCCNC(=O)c1cncs1 WXVL_AK00504SC0113 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.29 CCCNC(=O)c1cocn1 WXVL_AK00504SC0118 [0,2,0,0,0,0|1,0,1]=4 1023 B11R1.29 CCCNC(=O)c1cocn1 WXVL_AK00504SC0118 [0,2,0,0,0,0|1,0,1]=4 1024 B11R1.29 CCCNC(=O)c1cscn1 WXVL_AK00504SC0092 [0,2,0,0,0,0|1,0,1]=4 1025 B11R1.29 CCCNC(=O)c1cscn1 WXVL_AK00504SC0092 [0,2,0,0,0,0|1,0,1]=4 1026 B11R1.29 CCCNC(=O)c1nccs1 WXVL_AK00504SC0110 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.29 CCCNC(=O)c1nccs1 WXVL_AK00504SC0110 [0,2,0,0,0,0|1,0,1]=4 1028 B11R1.29 CCCNC(=O)c1nnc[nH]1 WXVL_AK00504SC00053 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.29 CCCNC(=O)c1nnc[nH]1 WXVL_AK00504SC00053 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.29 N#CCNC(=O)c1ccco1 WXVL_AK0683SC0049 [0,2,0,0,0,0|1,0,1]=4 1031 B11R1.29 N#CCNC(=O)c1ccco1 WXVL_AK0683SC0049 [0,2,0,0,0,0|1,0,1]=4 1032 B11R1.29 N#CCNC(=O)c1cccs1 WXVL_AK0683SC0051 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.29 N#CCNC(=O)c1cccs1 WXVL_AK0683SC0051 [0,2,0,0,0,0|1,0,1]=4 1034 B11R1.29 N#CCNC(=O)c1cnc[nH]1 WXVL_AK0683SC0247 [0,2,0,0,0,0|1,0,1]=4 1035 B11R1.29 N#CCNC(=O)c1cnc[nH]1 WXVL_AK0683SC0247 [0,2,0,0,0,0|1,0,1]=4 1036 B11R1.29 O=C(NCCF)c1c[nH]cn1 WXVL_AK00466SC0074 [0,2,0,0,0,0|1,0,1]=4 1037 B11R1.29 O=C(NCCF)c1c[nH]cn1 WXVL_AK00466SC0074 [0,2,0,0,0,0|1,0,1]=4 1038 B11R1.29 O=C(NCCF)c1cc[nH]c1 WXVL_AK00466SC0013 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.29 O=C(NCCF)c1cc[nH]c1 WXVL_AK00466SC0013 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.29 O=C(NCCF)c1cc[nH]n1 WXVL_AK00466SC0003 [0,2,0,0,0,0|1,0,1]=4 1041 B11R1.29 O=C(NCCF)c1cc[nH]n1 WXVL_AK00466SC0003 [0,2,0,0,0,0|1,0,1]=4 1042 B11R1.29 O=C(NCCF)c1ccco1 WXVL_AK00466SC0049 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.29 O=C(NCCF)c1ccco1 WXVL_AK00466SC0049 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.29 O=C(NCCF)c1cccs1 WXVL_AK00466SC0051 [0,2,0,0,0,0|1,0,0]=3 1045 B11R1.29 O=C(NCCF)c1cccs1 WXVL_AK00466SC0051 [0,2,0,0,0,0|1,0,0]=3 1046 B11R1.29 O=C(NCCF)c1ccno1 WXVL_AK00466SC0080 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.29 O=C(NCCF)c1ccno1 WXVL_AK00466SC0080 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.29 O=C(NCCF)c1ccns1 WXVL_AK00466SC0027 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.29 O=C(NCCF)c1ccns1 WXVL_AK00466SC0027 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.29 O=C(NCCF)c1ccoc1 WXVL_AK00466SC0050 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.29 O=C(NCCF)c1ccoc1 WXVL_AK00466SC0050 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.29 O=C(NCCF)c1ccon1 WXVL_AK00466SC0116 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.29 O=C(NCCF)c1ccon1 WXVL_AK00466SC0116 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.29 O=C(NCCF)c1ccsc1 WXVL_AK00466SC0054 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.29 O=C(NCCF)c1ccsc1 WXVL_AK00466SC0054 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.29 O=C(NCCF)c1ccsn1 WXVL_AK00466SC0764 [0,2,0,0,0,0|1,0,1]=4 1057 B11R1.29 O=C(NCCF)c1ccsn1 WXVL_AK00466SC0764 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.29 O=C(NCCF)c1cnc[nH]1 WXVL_AK00466SC0247 [0,2,0,0,0,0|1,0,0]=3 1059 B11R1.29 O=C(NCCF)c1cnc[nH]1 WXVL_AK00466SC0247 [0,2,0,0,0,0|1,0,0]=3 1060 B11R1.29 O=C(NCCF)c1cnco1 WXVL_AK00466SC0018 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.29 O=C(NCCF)c1cnco1 WXVL_AK00466SC0018 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.29 O=C(NCCF)c1cncs1 WXVL_AK00466SC0113 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.29 O=C(NCCF)c1cncs1 WXVL_AK00466SC0113 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.29 O=C(NCCF)c1cocn1 WXVL_AK00466SC0118 [0,2,0,0,0,0|1,0,1]=4 1065 B11R1.29 O=C(NCCF)c1cocn1 WXVL_AK00466SC0118 [0,2,0,0,0,0|1,0,1]=4 1066 B11R1.29 O=C(NCCF)c1cscn1 WXVL_AK00466SC0092 [0,2,0,0,0,0|1,0,1]=4 1067 B11R1.29 O=C(NCCF)c1cscn1 WXVL_AK00466SC0092 [0,2,0,0,0,0|1,0,1]=4 1068 B11R1.29 O=C(NCCF)c1nccs1 WXVL_AK00466SC0110 [0,2,0,0,0,0|1,0,1]=4 1069 B11R1.29 O=C(NCCF)c1nccs1 WXVL_AK00466SC0110 [0,2,0,0,0,0|1,0,1]=4 1070 B11R1.29 O=C(NCCF)c1nnc[nH]1 WXVL_AK00466SC00053 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.29 O=C(NCCF)c1nnc[nH]1 WXVL_AK00466SC00053 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.77 CC(C)NC(=O)c1c[nH]cn1 WXVL_AK0030SC0074 [0,2,0,0,0,0|1,0,1]=4 1073 B11R1.77 CC(C)NC(=O)c1c[nH]cn1 WXVL_AK0030SC0074 [0,2,0,0,0,0|1,0,1]=4 1074 B11R1.77 CC(C)NC(=O)c1cc[nH]c1 WXVL_AK0030SC0013 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.77 CC(C)NC(=O)c1cc[nH]c1 WXVL_AK0030SC0013 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.77 CC(C)NC(=O)c1cc[nH]n1 WXVL_AK0030SC0003 [0,2,0,0,0,0|1,0,1]=4 1077 B11R1.77 CC(C)NC(=O)c1cc[nH]n1 WXVL_AK0030SC0003 [0,2,0,0,0,0|1,0,1]=4 1078 B11R1.77 CC(C)NC(=O)c1ccco1 WXVL_AK0030SC0049 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.77 CC(C)NC(=O)c1ccco1 WXVL_AK0030SC0049 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.77 CC(C)NC(=O)c1cccs1 WXVL_AK0030SC0051 [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.77 CC(C)NC(=O)c1cccs1 WXVL_AK0030SC0051 [0,2,0,0,0,0|1,0,0]=3 1082 B11R1.77 CC(C)NC(=O)c1ccno1 WXVL_AK0030SC0080 [0,2,0,0,0,0|2,0,0]=4 1083 B11R1.77 CC(C)NC(=O)c1ccno1 WXVL_AK0030SC0080 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.77 CC(C)NC(=O)c1ccns1 WXVL_AK0030SC0027 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.77 CC(C)NC(=O)c1ccns1 WXVL_AK0030SC0027 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.77 CC(C)NC(=O)c1ccoc1 WXVL_AK0030SC0050 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.77 CC(C)NC(=O)c1ccoc1 WXVL_AK0030SC0050 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.77 CC(C)NC(=O)c1ccon1 WXVL_AK0030SC0116 [0,2,0,0,0,0|1,0,1]=4 1089 B11R1.77 CC(C)NC(=O)c1ccon1 WXVL_AK0030SC0116 [0,2,0,0,0,0|1,0,1]=4 1090 B11R1.77 CC(C)NC(=O)c1ccsc1 WXVL_AK0030SC0054 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.77 CC(C)NC(=O)c1ccsc1 WXVL_AK0030SC0054 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.77 CC(C)NC(=O)c1ccsn1 WXVL_AK0030SC0764 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.77 CC(C)NC(=O)c1ccsn1 WXVL_AK0030SC0764 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.77 CC(C)NC(=O)c1cnc[nH]1 WXVL_AK0030SC0247 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.77 CC(C)NC(=O)c1cnc[nH]1 WXVL_AK0030SC0247 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.77 CC(C)NC(=O)c1cnco1 WXVL_AK0030SC0018 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.77 CC(C)NC(=O)c1cnco1 WXVL_AK0030SC0018 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.77 CC(C)NC(=O)c1cncs1 WXVL_AK0030SC0113 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.77 CC(C)NC(=O)c1cncs1 WXVL_AK0030SC0113 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.77 CC(C)NC(=O)c1cocn1 WXVL_AK0030SC0118 [0,2,0,0,0,0|1,0,1]=4 1101 B11R1.77 CC(C)NC(=O)c1cocn1 WXVL_AK0030SC0118 [0,2,0,0,0,0|1,0,1]=4 1102 B11R1.77 CC(C)NC(=O)c1cscn1 WXVL_AK0030SC0092 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.77 CC(C)NC(=O)c1cscn1 WXVL_AK0030SC0092 [0,2,0,0,0,0|1,0,1]=4 1104 B11R1.77 CC(C)NC(=O)c1nccs1 WXVL_AK0030SC0110 [0,2,0,0,0,0|1,0,1]=4 1105 B11R1.77 CC(C)NC(=O)c1nccs1 WXVL_AK0030SC0110 [0,2,0,0,0,0|1,0,1]=4 1106 B11R1.77 CC(C)NC(=O)c1nnc[nH]1 WXVL_AK0030SC00053 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.77 CC(C)NC(=O)c1nnc[nH]1 WXVL_AK0030SC00053 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.199 CCNC(=O)c1[nH]ccc1C WXVL_AK00476SC1315 [0,2,0,0,0,0|0,0,0]=2 1109 B11R1.199 CCNC(=O)c1[nH]ccc1C WXVL_AK00476SC1315 [0,2,0,0,0,0|0,0,0]=2 1110 B11R1.199 CCNC(=O)c1[nH]cnc1C WXVL_AK00476SC0269 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.199 CCNC(=O)c1[nH]cnc1C WXVL_AK00476SC0269 [0,2,0,0,0,0|1,0,0]=3 1112 B11R1.199 CCNC(=O)c1c[nH]cc1C WXVL_AK00476SC0251 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.199 CCNC(=O)c1c[nH]cc1C WXVL_AK00476SC0251 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.199 CCNC(=O)c1ccnn1C WXVL_AK00476SC0090 [0,2,0,0,0,0|1,0,0]=3 1115 B11R1.199 CCNC(=O)c1ccnn1C WXVL_AK00476SC0090 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.199 CCNC(=O)c1ccsc1C WXVL_AK00476SC1037 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.199 CCNC(=O)c1ccsc1C WXVL_AK00476SC1037 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.199 CCNC(=O)c1ccsc1Cl WXVL_AK00476SC0794 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.199 CCNC(=O)c1ccsc1Cl WXVL_AK00476SC0794 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.199 CCNC(=O)c1cncn1C WXVL_AK00476SC0099 [0,2,0,0,0,0|1,0,0]=3 1121 B11R1.199 CCNC(=O)c1cncn1C WXVL_AK00476SC0099 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.199 CCNC(=O)c1cnnn1C WXVL_AK00476SC1006 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.199 CCNC(=O)c1cnnn1C WXVL_AK00476SC1006 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.199 CCNC(=O)c1cscc1Br WXVL_AK00476SC1024 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.199 CCNC(=O)c1cscc1Br WXVL_AK00476SC1024 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.199 CCNC(=O)c1cscc1C WXVL_AK00476SC0257 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.199 CCNC(=O)c1cscc1C WXVL_AK00476SC0257 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.199 CCNC(=O)c1n[nH]cc1I WXVL_AK00476SC0442 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.199 CCNC(=O)c1n[nH]cc1I WXVL_AK00476SC0442 [0,2,0,0,0,0|1,0,1]=4 1130 B11R1.199 CCNC(=O)c1nccn1C WXVL_AK00476SC0106 [0,2,0,0,0,0|1,0,0]=3 1131 B11R1.199 CCNC(=O)c1nccn1C WXVL_AK00476SC0106 [0,2,0,0,0,0|1,0,0]=3 1132 B11R1.199 CCNC(=O)c1ncnn1C WXVL_AK00476SC0037 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.199 CCNC(=O)c1ncnn1C WXVL_AK00476SC0037 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.199 CCNC(=O)c1ncoc1C WXVL_AK00476SC0732 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.199 CCNC(=O)c1ncoc1C WXVL_AK00476SC0732 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.199 CCNC(=O)c1ncsc1Br WXVL_AK00476SC0192 [0,2,0,0,0,0|1,0,1]=4 1137 B11R1.199 CCNC(=O)c1ncsc1Br WXVL_AK00476SC0192 [0,2,0,0,0,0|1,0,1]=4 1138 B11R1.199 CCNC(=O)c1ncsc1C WXVL_AK00476SC0722 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.199 CCNC(=O)c1ncsc1C WXVL_AK00476SC0722 [0,2,0,0,0,0|1,0,1]=4 1140 B11R1.199 CCNC(=O)c1occc1Br WXVL_AK00476SC0241 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.199 CCNC(=O)c1occc1Br WXVL_AK00476SC0241 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.199 CCNC(=O)c1occc1C WXVL_AK00476SC0230 [0,2,0,0,0,0|1,0,0]=3 1143 B11R1.199 CCNC(=O)c1occc1C WXVL_AK00476SC0230 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.199 CCNC(=O)c1ocnc1C WXVL_AK00476SC0103 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.199 CCNC(=O)c1ocnc1C WXVL_AK00476SC0103 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.199 CCNC(=O)c1oncc1C WXVL_AK00476SC0912 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.199 CCNC(=O)c1oncc1C WXVL_AK00476SC0912 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.199 CCNC(=O)c1sccc1Br WXVL_AK00476SC0364 [0,2,0,0,0,0|1,0,0]=3 1149 B11R1.199 CCNC(=O)c1sccc1Br WXVL_AK00476SC0364 [0,2,0,0,0,0|1,0,0]=3 1150 B11R1.199 CCNC(=O)c1sccc1C WXVL_AK00476SC0052 [0,2,0,0,0,0|1,0,0]=3 1151 B11R1.199 CCNC(=O)c1sccc1C WXVL_AK00476SC0052 [0,2,0,0,0,0|1,0,0]=3 1152 B11R1.199 CCNC(=O)c1sccc1Cl WXVL_AK00476SC0756 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.199 CCNC(=O)c1sccc1Cl WXVL_AK00476SC0756 [0,2,0,0,0,0|1,0,0]=3 1154 B11R1.199 CCNC(=O)c1sccc1F WXVL_AK00476SC0017 [0,2,0,0,0,0|1,0,0]=3 1155 B11R1.199 CCNC(=O)c1sccc1F WXVL_AK00476SC0017 [0,2,0,0,0,0|1,0,0]=3 1156 B11R1.199 CCNC(=O)c1sccc1I WXVL_AK00476SC1579 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.199 CCNC(=O)c1sccc1I WXVL_AK00476SC1579 [0,2,0,0,0,0|1,0,0]=3 1158 B11R1.199 CCNC(=O)c1scnc1C WXVL_AK00476SC0093 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.199 CCNC(=O)c1scnc1C WXVL_AK00476SC0093 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.44 CCc1cc([nH]n1)C(=O)NC WXVL_AK00442SC00027 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.44 CCc1cc([nH]n1)C(=O)NC WXVL_AK00442SC00027 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.44 CNC(=O)c1cc(c[nH]1)C#N WXVL_AK00442SC2642 [0,2,0,0,0,0|1,0,0]=3 1163 B11R1.44 CNC(=O)c1cc(c[nH]1)C#N WXVL_AK00442SC2642 [0,2,0,0,0,0|1,0,0]=3 1164 B11R1.44 CNC(=O)c1ccc(o1)CO WXVL_AK00442SC0443 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.44 CNC(=O)c1ccc(o1)CO WXVL_AK00442SC0443 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.44 CNC(=O)c1ccc(s1)C#N WXVL_AK00442SC0586 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.44 CNC(=O)c1ccc(s1)C#N WXVL_AK00442SC0586 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.44 CNC(=O)c1ccc(s1)OC WXVL_AK00442SC1134 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.44 CNC(=O)c1ccc(s1)OC WXVL_AK00442SC1134 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.44 CNC(=O)c1ccc(s1)SC WXVL_AK00442SC0929 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.44 CNC(=O)c1ccc(s1)SC WXVL_AK00442SC0929 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.225 CNC(=O)c1cc(cn1C)F WXVL_AK00442SC0315 [0,2,0,0,0,0|1,0,0]=3 1173 B11R1.225 CNC(=O)c1cc(cn1C)F WXVL_AK00442SC0315 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.225 CNC(=O)c1cc(nn1C)C WXVL_AK00442SC0081 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.225 CNC(=O)c1cc(nn1C)C WXVL_AK00442SC0081 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.225 CNC(=O)c1sc(cc1Br)Br WXVL_AK00442SC0250 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.225 CNC(=O)c1sc(cc1Br)Br WXVL_AK00442SC0250 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.226 CNC(=O)c1cc(c(s1)Br)C WXVL_AK00442SC1503 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.226 CNC(=O)c1cc(c(s1)Br)C WXVL_AK00442SC1503 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.226 CNC(=O)c1cc(c(s1)Br)Cl WXVL_AK00442SC1222 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.226 CNC(=O)c1cc(c(s1)Br)Cl WXVL_AK00442SC1222 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.226 CNC(=O)c1cc(c(s1)C)Br WXVL_AK00442SC1300 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.226 CNC(=O)c1cc(c(s1)C)Br WXVL_AK00442SC1300 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.226 CNC(=O)c1cc(c(s1)Cl)Cl WXVL_AK00442SC1256 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.226 CNC(=O)c1cc(c(s1)Cl)Cl WXVL_AK00442SC1256 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.314 CN(C)C(=O)c1cc(c[nH]1)Br WXVL_AN0032SC0644 [0,2,0,0,0,0|1,0,0]=3 1187 B11R1.314 CN(C)C(=O)c1cc(c[nH]1)Br WXVL_AN0032SC0644 [0,2,0,0,0,0|1,0,0]=3 1188 B11R1.314 CN(C)C(=O)c1cc(c[nH]1)F WXVL_AN0032SC0334 [0,2,0,0,0,0|1,0,0]=3 1189 B11R1.314 CN(C)C(=O)c1cc(c[nH]1)F WXVL_AN0032SC0334 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.314 CN(C)C(=O)c1cc(cs1)Br WXVL_AN0032SC0188 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.314 CN(C)C(=O)c1cc(cs1)Br WXVL_AN0032SC0188 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.314 CN(C)C(=O)c1ccc(o1)Cl WXVL_AN0032SC0926 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.314 CN(C)C(=O)c1ccc(o1)Cl WXVL_AN0032SC0926 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.314 CN(C)C(=O)c1ccc(s1)Br WXVL_AN0032SC0359 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.314 CN(C)C(=O)c1ccc(s1)Br WXVL_AN0032SC0359 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.314 CN(C)C(=O)c1ccc(s1)Cl WXVL_AN0032SC0067 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.314 CN(C)C(=O)c1ccc(s1)Cl WXVL_AN0032SC0067 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.314 CN(C)C(=O)c1cnc([nH]1)O WXVL_AN0032SC0498 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.314 CN(C)C(=O)c1cnc([nH]1)O WXVL_AN0032SC0498 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.314 Cc1c[nH]c(c1)C(=O)N(C)C WXVL_AN0032SC0830 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.314 Cc1c[nH]c(c1)C(=O)N(C)C WXVL_AN0032SC0830 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.314 Cc1cc([nH]n1)C(=O)N(C)C WXVL_AN0032SC2215 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.314 Cc1cc([nH]n1)C(=O)N(C)C WXVL_AN0032SC2215 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.314 Cc1ccc(o1)C(=O)N(C)C WXVL_AN0032SC0005 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.314 Cc1ccc(o1)C(=O)N(C)C WXVL_AN0032SC0005 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.314 Cc1ccc(s1)C(=O)N(C)C WXVL_AN0032SC0053 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.314 Cc1ccc(s1)C(=O)N(C)C WXVL_AN0032SC0053 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.314 Cc1csc(c1)C(=O)N(C)C WXVL_AN0032SC0004 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.314 Cc1csc(c1)C(=O)N(C)C WXVL_AN0032SC0004 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.865 CNC(=O)c1[nH]cc(c1C)C WXVL_AK00442SC0721 [0,2,0,0,0,0|1,0,0]=3 1211 B11R1.865 CNC(=O)c1[nH]cc(c1C)C WXVL_AK00442SC0721 [0,2,0,0,0,0|1,0,0]=3 1212 B11R1.865 CNC(=O)c1scc(c1C)C WXVL_AK00442SC1211 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.865 CNC(=O)c1scc(c1C)C WXVL_AK00442SC1211 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.865 CNC(=O)c1scc(c1Cl)C WXVL_AK00442SC0955 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.865 CNC(=O)c1scc(c1Cl)C WXVL_AK00442SC0955 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.89 CN(C)C(=O)c1ccnn1C WXVL_AN0032SC0090 [0,2,0,0,0,0|2,0,0]=4 1217 B11R1.89 CN(C)C(=O)c1ccnn1C WXVL_AN0032SC0090 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.89 CN(C)C(=O)c1cncn1C WXVL_AN0032SC0099 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.89 CN(C)C(=O)c1cncn1C WXVL_AN0032SC0099 [0,2,0,0,0,0|2,0,0]=4 1220 B11R1.89 CN(C)C(=O)c1nccn1C WXVL_AN0032SC0106 [0,2,0,0,0,0|2,0,0]=4 1221 B11R1.89 CN(C)C(=O)c1nccn1C WXVL_AN0032SC0106 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.89 CN(C)C(=O)c1occc1Br WXVL_AN0032SC0241 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.89 CN(C)C(=O)c1occc1Br WXVL_AN0032SC0241 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.89 CN(C)C(=O)c1sccc1Br WXVL_AN0032SC0364 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.89 CN(C)C(=O)c1sccc1Br WXVL_AN0032SC0364 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.89 CN(C)C(=O)c1sccc1Cl WXVL_AN0032SC0756 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.89 CN(C)C(=O)c1sccc1Cl WXVL_AN0032SC0756 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.89 CN(C)C(=O)c1sccc1F WXVL_AN0032SC0017 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.89 CN(C)C(=O)c1sccc1F WXVL_AN0032SC0017 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.89 CN(C)C(=O)c1sccc1I WXVL_AN0032SC1579 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.89 CN(C)C(=O)c1sccc1I WXVL_AN0032SC1579 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.89 Cc1cc[nH]c1C(=O)N(C)C WXVL_AN0032SC1315 [0,2,0,0,0,0|1,0,0]=3 1233 B11R1.89 Cc1cc[nH]c1C(=O)N(C)C WXVL_AN0032SC1315 [0,2,0,0,0,0|1,0,0]=3 1234 B11R1.89 Cc1ccoc1C(=O)N(C)C WXVL_AN0032SC0230 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.89 Cc1ccoc1C(=O)N(C)C WXVL_AN0032SC0230 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.89 Cc1ccsc1C(=O)N(C)C WXVL_AN0032SC0052 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.89 Cc1ccsc1C(=O)N(C)C WXVL_AN0032SC0052 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.89 Cc1nc[nH]c1C(=O)N(C)C WXVL_AN0032SC0269 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.89 Cc1nc[nH]c1C(=O)N(C)C WXVL_AN0032SC0269 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.89 Cn1cccc1C(=O)C(=O)N WXVL_AK0084SA2858 [0,2,0,0,0,0|1,0,1]=4 1241 B11R1.89 Cn1cccc1C(=O)C(=O)N WXVL_AK0084SA2858 [0,2,0,0,0,0|1,0,1]=4 1242 B11R1.59 CCn1nccc1C(=O)NC WXVL_AK00442SC0108 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.59 CCn1nccc1C(=O)NC WXVL_AK00442SC0108 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.59 CNC(=O)c1sccc1OC WXVL_AK00442SC0825 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.59 CNC(=O)c1sccc1OC WXVL_AK00442SC0825 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.875 CNC(=O)c1c(cnn1C)Br WXVL_AK00442SC0332 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.875 CNC(=O)c1c(cnn1C)Br WXVL_AK00442SC0332 [0,2,0,0,0,0|2,0,0]=4 1248 B11R2.2 C1=C(CCC1)c2cccs2 WXVL_LR0498BT0967 [0,1,0,1,0,0|2,0,0]=4 1249 B11R2.2 C1=C(CCC1)c2cnc[nH]2 WXVL_LR0418BT0967 [0,1,0,1,0,0|2,0,0]=4 1250 B11R2.2 C1=C(CCO1)c2cccs2 WXVL_LR0498BT5753 [0,1,0,1,0,0|1,0,1]=4 1251 B11R2.2 C1=C(CCO1)c2cnc[nH]2 WXVL_LR0418BT5753 [0,1,0,1,0,0|1,0,1]=4 1252 B11R2.2 C1=C(COC1)c2cccs2 WXVL_LR0498BT1456 [0,1,0,1,0,0|2,0,0]=4 1253 B11R2.2 C1=C(COC1)c2cnc[nH]2 WXVL_LR0418BT1456 [0,1,0,1,0,0|2,0,0]=4 1254 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,1|2,0,0]=4 1255 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,1|2,0,0]=4 1256 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,1|1,0,1]=4 1257 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,1|1,0,1]=4 1258 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,1|1,0,1]=4 1259 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,1|1,0,1]=4 1260 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,1|1,0,1]=4 1261 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,1|1,0,1]=4 1262 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,1|2,0,0]=4 1263 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,1|2,0,0]=4 1264 B9R1.6 NC(=O)c1ccncn1 WXVL_AK0084SC0231 [1,0,0,0,0,1|1,0,1]=4 1265 B9R1.6 NC(=O)c1ccncn1 WXVL_AK0084SC0231 [1,0,0,0,0,1|1,0,1]=4 1266 B9R1.6 NC(=O)c1ncccn1 WXVL_AK0084SC0096 [1,0,0,0,0,1|1,0,1]=4 1267 B9R1.6 NC(=O)c1ncccn1 WXVL_AK0084SC0096 [1,0,0,0,0,1|1,0,1]=4 1268 B9R1.8 CCNc1ccncn1 WXVL_AK00476LP3358 [1,0,0,0,0,1|1,0,1]=4 1269 B9R1.8 CCNc1ccncn1 WXVL_AK00476LP3358 [1,0,0,0,0,1|1,0,1]=4 1270 B9R1.8 CCNc1ncccn1 WXVL_AK00476LP0002 [1,0,0,0,0,1|1,0,1]=4 1271 B9R1.8 CCNc1ncccn1 WXVL_AK00476LP0002 [1,0,0,0,0,1|1,0,1]=4 1272 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,2|1,0,0]=3 1273 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,2|1,0,0]=3 1274 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,2|0,0,1]=3 1275 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,2|0,0,1]=3 1276 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,2|0,0,1]=3 1277 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,2|0,0,1]=3 1278 B11R1.40 CCC(=O)Nc1ccncn1 WXVL_AF0139SB0064 [0,0,0,0,0,2|0,0,1]=3 1279 B11R1.40 CCC(=O)Nc1ccncn1 WXVL_AF0139SB0064 [0,0,0,0,0,2|0,0,1]=3 1280 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,2|1,0,1]=4 1281 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,2|1,0,1]=4 1282 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,2|0,0,1]=3 1283 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,2|0,0,1]=3 1284 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,2|1,0,1]=4 1285 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,2|1,0,1]=4 1286 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,2|2,0,0]=4 1287 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,2|2,0,0]=4 1288 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,2|1,0,1]=4 1289 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,2|1,0,1]=4 1290 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,2|1,0,1]=4 1291 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,2|1,0,1]=4 1292 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,2|1,0,1]=4 1293 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,2|1,0,1]=4 1294 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,2|2,0,0]=4 1295 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,2|2,0,0]=4 1296 B11R1.40 CNC(=O)Cc1ncccn1 WXVL_AK00442SA0307 [0,0,0,0,0,2|1,0,1]=4 1297 B11R1.40 CNC(=O)Cc1ncccn1 WXVL_AK00442SA0307 [0,0,0,0,0,2|1,0,1]=4 1298 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,2|1,0,1]=4 1299 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,2|1,0,1]=4 1300 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,2|2,0,0]=4 1301 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,2|2,0,0]=4 1302 B11R1.40 O=C(CO)Nc1ccccn1 WXVL_AF00298SB2706 [0,0,0,0,0,2|1,0,1]=4 1303 B11R1.40 O=C(CO)Nc1ccccn1 WXVL_AF00298SB2706 [0,0,0,0,0,2|1,0,1]=4 1304 B11R1.40 O=C(CO)Nc1cccnn1 WXVL_AF0151SB2706 [0,0,0,0,0,2|1,0,1]=4 1305 B11R1.40 O=C(CO)Nc1cccnn1 WXVL_AF0151SB2706 [0,0,0,0,0,2|1,0,1]=4 1306 B11R1.40 O=C(CO)Nc1ccncn1 WXVL_AF0139SB2706 [0,0,0,0,0,2|1,0,1]=4 1307 B11R1.40 O=C(CO)Nc1ccncn1 WXVL_AF0139SB2706 [0,0,0,0,0,2|1,0,1]=4 1308 B11R1.40 O=C(CO)Nc1cnccn1 WXVL_AF0120SB2706 [0,0,0,0,0,2|1,0,1]=4 1309 B11R1.40 O=C(CO)Nc1cnccn1 WXVL_AF0120SB2706 [0,0,0,0,0,2|1,0,1]=4 1310 B11R1.25 C#CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0338 [0,0,0,0,0,2|0,0,2]=4 1311 B11R1.25 C#CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0338 [0,0,0,0,0,2|0,0,2]=4 1312 B11R1.25 CCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0064 [0,0,0,0,0,2|1,0,1]=4 1313 B11R1.25 CCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0064 [0,0,0,0,0,2|1,0,1]=4 1314 B11R1.25 CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0064 [0,0,0,0,0,2|0,0,0]=2 1315 B11R1.25 CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0064 [0,0,0,0,0,2|0,0,0]=2 1316 B11R1.25 CCC(=O)NCc1ccco1 WXVL_AK0010SB0064 [0,0,0,0,0,2|1,0,0]=3 1317 B11R1.25 CCC(=O)NCc1ccco1 WXVL_AK0010SB0064 [0,0,0,0,0,2|1,0,0]=3 1318 B11R1.25 CCC(=O)NCc1cccs1 WXVL_AK0014SB0064 [0,0,0,0,0,2|1,0,0]=3 1319 B11R1.25 CCC(=O)NCc1cccs1 WXVL_AK0014SB0064 [0,0,0,0,0,2|1,0,0]=3 1320 B11R1.25 CCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0064 [0,0,0,0,0,2|1,0,0]=3 1321 B11R1.25 CCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0064 [0,0,0,0,0,2|1,0,0]=3 1322 B11R1.25 CCC(=O)NCc1ccoc1 WXVL_AK2033SB0064 [0,0,0,0,0,2|2,0,0]=4 1323 B11R1.25 CCC(=O)NCc1ccoc1 WXVL_AK2033SB0064 [0,0,0,0,0,2|2,0,0]=4 1324 B11R1.25 CCC(=O)NCc1ccsc1 WXVL_AK00174SB0064 [0,0,0,0,0,2|2,0,0]=4 1325 B11R1.25 CCC(=O)NCc1ccsc1 WXVL_AK00174SB0064 [0,0,0,0,0,2|2,0,0]=4 1326 B11R1.25 CCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0064 [0,0,0,0,0,2|1,0,0]=3 1327 B11R1.25 CCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0064 [0,0,0,0,0,2|1,0,0]=3 1328 B11R1.25 CCC(=O)NCc1cnco1 WXVL_AK1437SB0064 [0,0,0,0,0,2|2,0,0]=4 1329 B11R1.25 CCC(=O)NCc1cnco1 WXVL_AK1437SB0064 [0,0,0,0,0,2|2,0,0]=4 1330 B11R1.25 CCC(=O)NCc1cncs1 WXVL_AK0526SB0064 [0,0,0,0,0,2|2,0,0]=4 1331 B11R1.25 CCC(=O)NCc1cncs1 WXVL_AK0526SB0064 [0,0,0,0,0,2|2,0,0]=4 1332 B11R1.25 CCC(=O)NCc1cocn1 WXVL_AK00016SB0064 [0,0,0,0,0,2|1,0,1]=4 1333 B11R1.25 CCC(=O)NCc1cocn1 WXVL_AK00016SB0064 [0,0,0,0,0,2|1,0,1]=4 1334 B11R1.25 CCC(=O)NCc1cscn1 WXVL_AK0325SB0064 [0,0,0,0,0,2|1,0,1]=4 1335 B11R1.25 CCC(=O)NCc1cscn1 WXVL_AK0325SB0064 [0,0,0,0,0,2|1,0,1]=4 1336 B11R1.25 CCC(=O)NCc1nccs1 WXVL_AK0153SB0064 [0,0,0,0,0,2|1,0,1]=4 1337 B11R1.25 CCC(=O)NCc1nccs1 WXVL_AK0153SB0064 [0,0,0,0,0,2|1,0,1]=4 1338 B11R1.25 CNC(=O)/C=C/c1ccco1 WXVL_AK00442SA0180 [0,0,0,0,0,2|2,0,0]=4 1339 B11R1.25 CNC(=O)/C=C/c1ccco1 WXVL_AK00442SA0180 [0,0,0,0,0,2|2,0,0]=4 1340 B11R1.25 CNC(=O)/C=C/c1cccs1 WXVL_AK00442SA0001 [0,0,0,0,0,2|2,0,0]=4 1341 B11R1.25 CNC(=O)/C=C/c1cccs1 WXVL_AK00442SA0001 [0,0,0,0,0,2|2,0,0]=4 1342 B11R1.25 CNC(=O)CCc1ccc[nH]1 WXVL_AK00442SA0009 [0,0,0,0,0,2|1,0,0]=3 1343 B11R1.25 CNC(=O)CCc1ccc[nH]1 WXVL_AK00442SA0009 [0,0,0,0,0,2|1,0,0]=3 1344 B11R1.25 CNC(=O)CCc1ccco1 WXVL_AK00442SA0167 [0,0,0,0,0,2|2,0,0]=4 1345 B11R1.25 CNC(=O)CCc1ccco1 WXVL_AK00442SA0167 [0,0,0,0,0,2|2,0,0]=4 1346 B11R1.25 CNC(=O)CCc1cccs1 WXVL_AK00442SA0303 [0,0,0,0,0,2|2,0,0]=4 1347 B11R1.25 CNC(=O)CCc1cccs1 WXVL_AK00442SA0303 [0,0,0,0,0,2|2,0,0]=4 1348 B11R1.25 CNC(=O)CCc1cnc[nH]1 WXVL_AK00442SA0100 [0,0,0,0,0,2|2,0,0]=4 1349 B11R1.25 CNC(=O)CCc1cnc[nH]1 WXVL_AK00442SA0100 [0,0,0,0,0,2|2,0,0]=4 1350 B11R1.25 CNC(=O)CCc1ncc[nH]1 WXVL_AK00442SA0555 [0,0,0,0,0,2|2,0,0]=4 1351 B11R1.25 CNC(=O)CCc1ncc[nH]1 WXVL_AK00442SA0555 [0,0,0,0,0,2|2,0,0]=4 1352 B11R1.25 O=C(CO)NCc1ccc[nH]1 WXVL_AK00759SB2706 [0,0,0,0,0,2|1,0,0]=3 1353 B11R1.25 O=C(CO)NCc1ccc[nH]1 WXVL_AK00759SB2706 [0,0,0,0,0,2|1,0,0]=3 1354 B11R1.25 O=C(CO)NCc1ccco1 WXVL_AK0010SB2706 [0,0,0,0,0,2|2,0,0]=4 1355 B11R1.25 O=C(CO)NCc1ccco1 WXVL_AK0010SB2706 [0,0,0,0,0,2|2,0,0]=4 1356 B11R1.25 O=C(CO)NCc1cccs1 WXVL_AK0014SB2706 [0,0,0,0,0,2|2,0,0]=4 1357 B11R1.25 O=C(CO)NCc1cccs1 WXVL_AK0014SB2706 [0,0,0,0,0,2|2,0,0]=4 1358 B11R1.25 O=C(CO)NCc1ccn[nH]1 WXVL_AK0459SB2706 [0,0,0,0,0,2|2,0,0]=4 1359 B11R1.25 O=C(CO)NCc1ccn[nH]1 WXVL_AK0459SB2706 [0,0,0,0,0,2|2,0,0]=4 1360 B11R1.25 O=C(CO)NCc1cnc[nH]1 WXVL_AK00778SB2706 [0,0,0,0,0,2|2,0,0]=4 1361 B11R1.25 O=C(CO)NCc1cnc[nH]1 WXVL_AK00778SB2706 [0,0,0,0,0,2|2,0,0]=4