0 B14R2.793 O=C(Nc1ccn[nH]1)c2c[nH]cn2 WXVL_AF0122SC0074 [0,0,1,0,0,0|1,0,1]=3 1 B14R2.793 O=C(Nc1ccn[nH]1)c2c[nH]cn2 WXVL_AF0122SC0074 [0,0,1,0,0,0|1,0,1]=3 2 B14R2.793 O=C(Nc1ccn[nH]1)c2cc[nH]c2 WXVL_AF0122SC0013 [0,0,1,0,0,0|2,0,1]=4 3 B14R2.793 O=C(Nc1ccn[nH]1)c2cc[nH]c2 WXVL_AF0122SC0013 [0,0,1,0,0,0|2,0,1]=4 4 B14R2.793 O=C(Nc1ccn[nH]1)c2cc[nH]n2 WXVL_AF0122SC0003 [0,0,1,0,0,0|3,0,0]=4 5 B14R2.793 O=C(Nc1ccn[nH]1)c2cc[nH]n2 WXVL_AF0122SC0003 [0,0,1,0,0,0|3,0,0]=4 6 B14R2.793 O=C(Nc1ccn[nH]1)c2ccco2 WXVL_AF0122SC0049 [0,0,1,0,0,0|3,0,0]=4 7 B14R2.793 O=C(Nc1ccn[nH]1)c2ccco2 WXVL_AF0122SC0049 [0,0,1,0,0,0|3,0,0]=4 8 B14R2.793 O=C(Nc1ccn[nH]1)c2cccs2 WXVL_AF0122SC0051 [0,0,1,0,0,0|3,0,0]=4 9 B14R2.793 O=C(Nc1ccn[nH]1)c2cccs2 WXVL_AF0122SC0051 [0,0,1,0,0,0|3,0,0]=4 10 B14R2.793 O=C(Nc1ccn[nH]1)c2ccno2 WXVL_AF0122SC0080 [0,0,1,0,0,0|3,0,0]=4 11 B14R2.793 O=C(Nc1ccn[nH]1)c2ccno2 WXVL_AF0122SC0080 [0,0,1,0,0,0|3,0,0]=4 12 B14R2.793 O=C(Nc1ccn[nH]1)c2ccns2 WXVL_AF0122SC0027 [0,0,1,0,0,0|3,0,0]=4 13 B14R2.793 O=C(Nc1ccn[nH]1)c2ccns2 WXVL_AF0122SC0027 [0,0,1,0,0,0|3,0,0]=4 14 B14R2.793 O=C(Nc1ccn[nH]1)c2ccoc2 WXVL_AF0122SC0050 [0,0,1,0,0,0|3,0,0]=4 15 B14R2.793 O=C(Nc1ccn[nH]1)c2ccoc2 WXVL_AF0122SC0050 [0,0,1,0,0,0|3,0,0]=4 16 B14R2.793 O=C(Nc1ccn[nH]1)c2ccon2 WXVL_AF0122SC0116 [0,0,1,0,0,0|3,0,0]=4 17 B14R2.793 O=C(Nc1ccn[nH]1)c2ccon2 WXVL_AF0122SC0116 [0,0,1,0,0,0|3,0,0]=4 18 B14R2.793 O=C(Nc1ccn[nH]1)c2ccsc2 WXVL_AF0122SC0054 [0,0,1,0,0,0|3,0,0]=4 19 B14R2.793 O=C(Nc1ccn[nH]1)c2ccsc2 WXVL_AF0122SC0054 [0,0,1,0,0,0|3,0,0]=4 20 B14R2.793 O=C(Nc1ccn[nH]1)c2ccsn2 WXVL_AF0122SC0764 [0,0,1,0,0,0|3,0,0]=4 21 B14R2.793 O=C(Nc1ccn[nH]1)c2ccsn2 WXVL_AF0122SC0764 [0,0,1,0,0,0|3,0,0]=4 22 B14R2.793 O=C(Nc1ccn[nH]1)c2cn[nH]c2 WXVL_AF0122SC0254 [0,0,1,0,0,0|3,0,0]=4 23 B14R2.793 O=C(Nc1ccn[nH]1)c2cn[nH]c2 WXVL_AF0122SC0254 [0,0,1,0,0,0|3,0,0]=4 24 B14R2.793 O=C(Nc1ccn[nH]1)c2cnc[nH]2 WXVL_AF0122SC0247 [0,0,1,0,0,0|1,0,1]=3 25 B14R2.793 O=C(Nc1ccn[nH]1)c2cnc[nH]2 WXVL_AF0122SC0247 [0,0,1,0,0,0|1,0,1]=3 26 B14R2.793 O=C(Nc1ccn[nH]1)c2cnco2 WXVL_AF0122SC0018 [0,0,1,0,0,0|2,0,0]=3 27 B14R2.793 O=C(Nc1ccn[nH]1)c2cnco2 WXVL_AF0122SC0018 [0,0,1,0,0,0|2,0,0]=3 28 B14R2.793 O=C(Nc1ccn[nH]1)c2cncs2 WXVL_AF0122SC0113 [0,0,1,0,0,0|2,0,0]=3 29 B14R2.793 O=C(Nc1ccn[nH]1)c2cncs2 WXVL_AF0122SC0113 [0,0,1,0,0,0|2,0,0]=3 30 B14R2.793 O=C(Nc1ccn[nH]1)c2cnon2 WXVL_AF0122SC0777 [0,0,1,0,0,0|2,0,0]=3 31 B14R2.793 O=C(Nc1ccn[nH]1)c2cnon2 WXVL_AF0122SC0777 [0,0,1,0,0,0|2,0,0]=3 32 B14R2.793 O=C(Nc1ccn[nH]1)c2cnsn2 WXVL_AF0122SC1291 [0,0,1,0,0,0|2,0,0]=3 33 B14R2.793 O=C(Nc1ccn[nH]1)c2cnsn2 WXVL_AF0122SC1291 [0,0,1,0,0,0|2,0,0]=3 34 B14R2.793 O=C(Nc1ccn[nH]1)c2cocn2 WXVL_AF0122SC0118 [0,0,1,0,0,0|2,0,0]=3 35 B14R2.793 O=C(Nc1ccn[nH]1)c2cocn2 WXVL_AF0122SC0118 [0,0,1,0,0,0|2,0,0]=3 36 B14R2.793 O=C(Nc1ccn[nH]1)c2cscn2 WXVL_AF0122SC0092 [0,0,1,0,0,0|2,0,0]=3 37 B14R2.793 O=C(Nc1ccn[nH]1)c2cscn2 WXVL_AF0122SC0092 [0,0,1,0,0,0|2,0,0]=3 38 B14R2.793 O=C(Nc1ccn[nH]1)c2csnn2 WXVL_AF0122SC0002 [0,0,1,0,0,0|3,0,0]=4 39 B14R2.793 O=C(Nc1ccn[nH]1)c2csnn2 WXVL_AF0122SC0002 [0,0,1,0,0,0|3,0,0]=4 40 B14R2.793 O=C(Nc1ccn[nH]1)c2nc[nH]n2 WXVL_AF0122SC0376 [0,0,1,0,0,0|2,0,1]=4 41 B14R2.793 O=C(Nc1ccn[nH]1)c2nc[nH]n2 WXVL_AF0122SC0376 [0,0,1,0,0,0|2,0,1]=4 42 B14R2.793 O=C(Nc1ccn[nH]1)c2nccs2 WXVL_AF0122SC0110 [0,0,1,0,0,0|3,0,0]=4 43 B14R2.793 O=C(Nc1ccn[nH]1)c2nccs2 WXVL_AF0122SC0110 [0,0,1,0,0,0|3,0,0]=4 44 B14R2.793 O=C(Nc1ccn[nH]1)c2nnc[nH]2 WXVL_AF0122SC00053 [0,0,1,0,0,0|2,0,1]=4 45 B14R2.793 O=C(Nc1ccn[nH]1)c2nnc[nH]2 WXVL_AF0122SC00053 [0,0,1,0,0,0|2,0,1]=4 46 B14R2.793 O=C(Nc1ccno1)c2c[nH]cn2 WXVL_AF0588SC0074 [0,0,1,0,0,0|2,0,1]=4 47 B14R2.793 O=C(Nc1ccno1)c2c[nH]cn2 WXVL_AF0588SC0074 [0,0,1,0,0,0|2,0,1]=4 48 B14R2.793 O=C(Nc1ccno1)c2cnc[nH]2 WXVL_AF0588SC0247 [0,0,1,0,0,0|2,0,1]=4 49 B14R2.793 O=C(Nc1ccno1)c2cnc[nH]2 WXVL_AF0588SC0247 [0,0,1,0,0,0|2,0,1]=4 50 B14R2.793 O=C(Nc1ccno1)c2cnco2 WXVL_AF0588SC0018 [0,0,1,0,0,0|3,0,0]=4 51 B14R2.793 O=C(Nc1ccno1)c2cnco2 WXVL_AF0588SC0018 [0,0,1,0,0,0|3,0,0]=4 52 B14R2.793 O=C(Nc1ccno1)c2cncs2 WXVL_AF0588SC0113 [0,0,1,0,0,0|3,0,0]=4 53 B14R2.793 O=C(Nc1ccno1)c2cncs2 WXVL_AF0588SC0113 [0,0,1,0,0,0|3,0,0]=4 54 B14R2.793 O=C(Nc1ccno1)c2cnon2 WXVL_AF0588SC0777 [0,0,1,0,0,0|3,0,0]=4 55 B14R2.793 O=C(Nc1ccno1)c2cnon2 WXVL_AF0588SC0777 [0,0,1,0,0,0|3,0,0]=4 56 B14R2.793 O=C(Nc1ccno1)c2cnsn2 WXVL_AF0588SC1291 [0,0,1,0,0,0|3,0,0]=4 57 B14R2.793 O=C(Nc1ccno1)c2cnsn2 WXVL_AF0588SC1291 [0,0,1,0,0,0|3,0,0]=4 58 B14R2.793 O=C(Nc1ccno1)c2cocn2 WXVL_AF0588SC0118 [0,0,1,0,0,0|3,0,0]=4 59 B14R2.793 O=C(Nc1ccno1)c2cocn2 WXVL_AF0588SC0118 [0,0,1,0,0,0|3,0,0]=4 60 B14R2.793 O=C(Nc1ccno1)c2cscn2 WXVL_AF0588SC0092 [0,0,1,0,0,0|3,0,0]=4 61 B14R2.793 O=C(Nc1ccno1)c2cscn2 WXVL_AF0588SC0092 [0,0,1,0,0,0|3,0,0]=4 62 B14R2.793 O=C(Nc1ccns1)c2c[nH]cn2 WXVL_AF00325SC0074 [0,0,1,0,0,0|2,0,1]=4 63 B14R2.793 O=C(Nc1ccns1)c2c[nH]cn2 WXVL_AF00325SC0074 [0,0,1,0,0,0|2,0,1]=4 64 B14R2.793 O=C(Nc1ccns1)c2cnc[nH]2 WXVL_AF00325SC0247 [0,0,1,0,0,0|2,0,1]=4 65 B14R2.793 O=C(Nc1ccns1)c2cnc[nH]2 WXVL_AF00325SC0247 [0,0,1,0,0,0|2,0,1]=4 66 B14R2.793 O=C(Nc1ccns1)c2cnco2 WXVL_AF00325SC0018 [0,0,1,0,0,0|3,0,0]=4 67 B14R2.793 O=C(Nc1ccns1)c2cnco2 WXVL_AF00325SC0018 [0,0,1,0,0,0|3,0,0]=4 68 B14R2.793 O=C(Nc1ccns1)c2cncs2 WXVL_AF00325SC0113 [0,0,1,0,0,0|3,0,0]=4 69 B14R2.793 O=C(Nc1ccns1)c2cncs2 WXVL_AF00325SC0113 [0,0,1,0,0,0|3,0,0]=4 70 B14R2.793 O=C(Nc1ccns1)c2cnon2 WXVL_AF00325SC0777 [0,0,1,0,0,0|3,0,0]=4 71 B14R2.793 O=C(Nc1ccns1)c2cnon2 WXVL_AF00325SC0777 [0,0,1,0,0,0|3,0,0]=4 72 B14R2.793 O=C(Nc1ccns1)c2cnsn2 WXVL_AF00325SC1291 [0,0,1,0,0,0|3,0,0]=4 73 B14R2.793 O=C(Nc1ccns1)c2cnsn2 WXVL_AF00325SC1291 [0,0,1,0,0,0|3,0,0]=4 74 B14R2.793 O=C(Nc1ccns1)c2cocn2 WXVL_AF00325SC0118 [0,0,1,0,0,0|3,0,0]=4 75 B14R2.793 O=C(Nc1ccns1)c2cocn2 WXVL_AF00325SC0118 [0,0,1,0,0,0|3,0,0]=4 76 B14R2.793 O=C(Nc1ccns1)c2cscn2 WXVL_AF00325SC0092 [0,0,1,0,0,0|3,0,0]=4 77 B14R2.793 O=C(Nc1ccns1)c2cscn2 WXVL_AF00325SC0092 [0,0,1,0,0,0|3,0,0]=4 78 B15R2.285 Cc1cc([nH]n1)NC(=O)c2c[nH]cn2 WXVL_AF0238SC0074 [0,1,1,0,0,0|1,0,1]=4 79 B15R2.285 Cc1cc([nH]n1)NC(=O)c2c[nH]cn2 WXVL_AF0238SC0074 [0,1,1,0,0,0|1,0,1]=4 80 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnc[nH]2 WXVL_AF0238SC0247 [0,1,1,0,0,0|1,0,1]=4 81 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnc[nH]2 WXVL_AF0238SC0247 [0,1,1,0,0,0|1,0,1]=4 82 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnco2 WXVL_AF0238SC0018 [0,1,1,0,0,0|2,0,0]=4 83 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnco2 WXVL_AF0238SC0018 [0,1,1,0,0,0|2,0,0]=4 84 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cncs2 WXVL_AF0238SC0113 [0,1,1,0,0,0|2,0,0]=4 85 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cncs2 WXVL_AF0238SC0113 [0,1,1,0,0,0|2,0,0]=4 86 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnon2 WXVL_AF0238SC0777 [0,1,1,0,0,0|2,0,0]=4 87 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnon2 WXVL_AF0238SC0777 [0,1,1,0,0,0|2,0,0]=4 88 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnsn2 WXVL_AF0238SC1291 [0,1,1,0,0,0|2,0,0]=4 89 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cnsn2 WXVL_AF0238SC1291 [0,1,1,0,0,0|2,0,0]=4 90 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cocn2 WXVL_AF0238SC0118 [0,1,1,0,0,0|2,0,0]=4 91 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cocn2 WXVL_AF0238SC0118 [0,1,1,0,0,0|2,0,0]=4 92 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cscn2 WXVL_AF0238SC0092 [0,1,1,0,0,0|2,0,0]=4 93 B15R2.285 Cc1cc([nH]n1)NC(=O)c2cscn2 WXVL_AF0238SC0092 [0,1,1,0,0,0|2,0,0]=4 94 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2c[nH]cn2 WXVL_AF4634SC0074 [0,1,1,0,0,0|1,0,1]=4 95 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2c[nH]cn2 WXVL_AF4634SC0074 [0,1,1,0,0,0|1,0,1]=4 96 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnc[nH]2 WXVL_AF4634SC0247 [0,1,1,0,0,0|1,0,1]=4 97 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnc[nH]2 WXVL_AF4634SC0247 [0,1,1,0,0,0|1,0,1]=4 98 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnco2 WXVL_AF4634SC0018 [0,1,1,0,0,0|2,0,0]=4 99 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnco2 WXVL_AF4634SC0018 [0,1,1,0,0,0|2,0,0]=4 100 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cncs2 WXVL_AF4634SC0113 [0,1,1,0,0,0|2,0,0]=4 101 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cncs2 WXVL_AF4634SC0113 [0,1,1,0,0,0|2,0,0]=4 102 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnon2 WXVL_AF4634SC0777 [0,1,1,0,0,0|2,0,0]=4 103 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnon2 WXVL_AF4634SC0777 [0,1,1,0,0,0|2,0,0]=4 104 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnsn2 WXVL_AF4634SC1291 [0,1,1,0,0,0|2,0,0]=4 105 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cnsn2 WXVL_AF4634SC1291 [0,1,1,0,0,0|2,0,0]=4 106 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cocn2 WXVL_AF4634SC0118 [0,1,1,0,0,0|2,0,0]=4 107 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cocn2 WXVL_AF4634SC0118 [0,1,1,0,0,0|2,0,0]=4 108 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cscn2 WXVL_AF4634SC0092 [0,1,1,0,0,0|2,0,0]=4 109 B15R2.285 O=C(Nc1cc(n[nH]1)Br)c2cscn2 WXVL_AF4634SC0092 [0,1,1,0,0,0|2,0,0]=4 110 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2c[nH]cn2 WXVL_AF0232SC0074 [0,1,1,0,0,0|1,0,1]=4 111 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2c[nH]cn2 WXVL_AF0232SC0074 [0,1,1,0,0,0|1,0,1]=4 112 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnc[nH]2 WXVL_AF0232SC0247 [0,1,1,0,0,0|1,0,1]=4 113 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnc[nH]2 WXVL_AF0232SC0247 [0,1,1,0,0,0|1,0,1]=4 114 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnco2 WXVL_AF0232SC0018 [0,1,1,0,0,0|2,0,0]=4 115 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnco2 WXVL_AF0232SC0018 [0,1,1,0,0,0|2,0,0]=4 116 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cncs2 WXVL_AF0232SC0113 [0,1,1,0,0,0|2,0,0]=4 117 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cncs2 WXVL_AF0232SC0113 [0,1,1,0,0,0|2,0,0]=4 118 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnon2 WXVL_AF0232SC0777 [0,1,1,0,0,0|2,0,0]=4 119 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnon2 WXVL_AF0232SC0777 [0,1,1,0,0,0|2,0,0]=4 120 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnsn2 WXVL_AF0232SC1291 [0,1,1,0,0,0|2,0,0]=4 121 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cnsn2 WXVL_AF0232SC1291 [0,1,1,0,0,0|2,0,0]=4 122 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cocn2 WXVL_AF0232SC0118 [0,1,1,0,0,0|2,0,0]=4 123 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cocn2 WXVL_AF0232SC0118 [0,1,1,0,0,0|2,0,0]=4 124 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cscn2 WXVL_AF0232SC0092 [0,1,1,0,0,0|2,0,0]=4 125 B15R2.285 O=C(Nc1cc(n[nH]1)O)c2cscn2 WXVL_AF0232SC0092 [0,1,1,0,0,0|2,0,0]=4 126 B15R2.289 Cc1nc(c[nH]1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0009 [0,1,1,0,0,0|1,0,1]=4 127 B15R2.289 Cc1nc(c[nH]1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0009 [0,1,1,0,0,0|1,0,1]=4 128 B15R2.289 Cc1nc(co1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0086 [0,1,1,0,0,0|2,0,0]=4 129 B15R2.289 Cc1nc(co1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0086 [0,1,1,0,0,0|2,0,0]=4 130 B15R2.289 Cc1nc(cs1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0112 [0,1,1,0,0,0|2,0,0]=4 131 B15R2.289 Cc1nc(cs1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0112 [0,1,1,0,0,0|2,0,0]=4 132 B15R2.289 Cc1ncc(s1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0326 [0,1,1,0,0,0|2,0,0]=4 133 B15R2.289 Cc1ncc(s1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0326 [0,1,1,0,0,0|2,0,0]=4 134 B15R2.289 Cn1cnc(c1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0111 [0,1,1,0,0,0|1,0,1]=4 135 B15R2.289 Cn1cnc(c1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0111 [0,1,1,0,0,0|1,0,1]=4 136 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc([nH]2)O WXVL_AF0122SC0498 [0,1,1,0,0,0|1,0,1]=4 137 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc([nH]2)O WXVL_AF0122SC0498 [0,1,1,0,0,0|1,0,1]=4 138 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(o2)Br WXVL_AF0122SC0815 [0,1,1,0,0,0|2,0,0]=4 139 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(o2)Br WXVL_AF0122SC0815 [0,1,1,0,0,0|2,0,0]=4 140 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(s2)Br WXVL_AF0122SC0723 [0,1,1,0,0,0|2,0,0]=4 141 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(s2)Br WXVL_AF0122SC0723 [0,1,1,0,0,0|2,0,0]=4 142 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(s2)Cl WXVL_AF0122SC0638 [0,1,1,0,0,0|2,0,0]=4 143 B15R2.289 O=C(Nc1ccn[nH]1)c2cnc(s2)Cl WXVL_AF0122SC0638 [0,1,1,0,0,0|2,0,0]=4 144 B15R2.289 O=C(Nc1ccn[nH]1)c2coc(n2)Cl WXVL_AF0122SC1341 [0,1,1,0,0,0|2,0,0]=4 145 B15R2.289 O=C(Nc1ccn[nH]1)c2coc(n2)Cl WXVL_AF0122SC1341 [0,1,1,0,0,0|2,0,0]=4 146 B15R2.289 O=C(Nc1ccn[nH]1)c2csc(n2)Cl WXVL_AF0122SC0688 [0,1,1,0,0,0|2,0,0]=4 147 B15R2.289 O=C(Nc1ccn[nH]1)c2csc(n2)Cl WXVL_AF0122SC0688 [0,1,1,0,0,0|2,0,0]=4 148 B15R2.402 Cc1cn[nH]c1NC(=O)c2c[nH]cn2 WXVL_AF0173SC0074 [0,1,1,0,0,0|1,0,1]=4 149 B15R2.402 Cc1cn[nH]c1NC(=O)c2c[nH]cn2 WXVL_AF0173SC0074 [0,1,1,0,0,0|1,0,1]=4 150 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnc[nH]2 WXVL_AF0173SC0247 [0,1,1,0,0,0|1,0,1]=4 151 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnc[nH]2 WXVL_AF0173SC0247 [0,1,1,0,0,0|1,0,1]=4 152 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnco2 WXVL_AF0173SC0018 [0,1,1,0,0,0|2,0,0]=4 153 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnco2 WXVL_AF0173SC0018 [0,1,1,0,0,0|2,0,0]=4 154 B15R2.402 Cc1cn[nH]c1NC(=O)c2cncs2 WXVL_AF0173SC0113 [0,1,1,0,0,0|2,0,0]=4 155 B15R2.402 Cc1cn[nH]c1NC(=O)c2cncs2 WXVL_AF0173SC0113 [0,1,1,0,0,0|2,0,0]=4 156 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnon2 WXVL_AF0173SC0777 [0,1,1,0,0,0|2,0,0]=4 157 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnon2 WXVL_AF0173SC0777 [0,1,1,0,0,0|2,0,0]=4 158 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnsn2 WXVL_AF0173SC1291 [0,1,1,0,0,0|2,0,0]=4 159 B15R2.402 Cc1cn[nH]c1NC(=O)c2cnsn2 WXVL_AF0173SC1291 [0,1,1,0,0,0|2,0,0]=4 160 B15R2.402 Cc1cn[nH]c1NC(=O)c2cocn2 WXVL_AF0173SC0118 [0,1,1,0,0,0|2,0,0]=4 161 B15R2.402 Cc1cn[nH]c1NC(=O)c2cocn2 WXVL_AF0173SC0118 [0,1,1,0,0,0|2,0,0]=4 162 B15R2.402 Cc1cn[nH]c1NC(=O)c2cscn2 WXVL_AF0173SC0092 [0,1,1,0,0,0|2,0,0]=4 163 B15R2.402 Cc1cn[nH]c1NC(=O)c2cscn2 WXVL_AF0173SC0092 [0,1,1,0,0,0|2,0,0]=4 164 B15R2.402 Cn1nccc1NC(=O)c2c[nH]cn2 WXVL_AF0198SC0074 [0,1,1,0,0,0|1,0,1]=4 165 B15R2.402 Cn1nccc1NC(=O)c2c[nH]cn2 WXVL_AF0198SC0074 [0,1,1,0,0,0|1,0,1]=4 166 B15R2.402 Cn1nccc1NC(=O)c2cnc[nH]2 WXVL_AF0198SC0247 [0,1,1,0,0,0|1,0,1]=4 167 B15R2.402 Cn1nccc1NC(=O)c2cnc[nH]2 WXVL_AF0198SC0247 [0,1,1,0,0,0|1,0,1]=4 168 B15R2.402 Cn1nccc1NC(=O)c2cnco2 WXVL_AF0198SC0018 [0,1,1,0,0,0|2,0,0]=4 169 B15R2.402 Cn1nccc1NC(=O)c2cnco2 WXVL_AF0198SC0018 [0,1,1,0,0,0|2,0,0]=4 170 B15R2.402 Cn1nccc1NC(=O)c2cncs2 WXVL_AF0198SC0113 [0,1,1,0,0,0|2,0,0]=4 171 B15R2.402 Cn1nccc1NC(=O)c2cncs2 WXVL_AF0198SC0113 [0,1,1,0,0,0|2,0,0]=4 172 B15R2.402 Cn1nccc1NC(=O)c2cnon2 WXVL_AF0198SC0777 [0,1,1,0,0,0|2,0,0]=4 173 B15R2.402 Cn1nccc1NC(=O)c2cnon2 WXVL_AF0198SC0777 [0,1,1,0,0,0|2,0,0]=4 174 B15R2.402 Cn1nccc1NC(=O)c2cnsn2 WXVL_AF0198SC1291 [0,1,1,0,0,0|2,0,0]=4 175 B15R2.402 Cn1nccc1NC(=O)c2cnsn2 WXVL_AF0198SC1291 [0,1,1,0,0,0|2,0,0]=4 176 B15R2.402 Cn1nccc1NC(=O)c2cocn2 WXVL_AF0198SC0118 [0,1,1,0,0,0|2,0,0]=4 177 B15R2.402 Cn1nccc1NC(=O)c2cocn2 WXVL_AF0198SC0118 [0,1,1,0,0,0|2,0,0]=4 178 B15R2.402 Cn1nccc1NC(=O)c2cscn2 WXVL_AF0198SC0092 [0,1,1,0,0,0|2,0,0]=4 179 B15R2.402 Cn1nccc1NC(=O)c2cscn2 WXVL_AF0198SC0092 [0,1,1,0,0,0|2,0,0]=4 180 B15R2.402 O=C(Nc1[nH]ncc1Br)c2c[nH]cn2 WXVL_AF0131SC0074 [0,1,1,0,0,0|1,0,1]=4 181 B15R2.402 O=C(Nc1[nH]ncc1Br)c2c[nH]cn2 WXVL_AF0131SC0074 [0,1,1,0,0,0|1,0,1]=4 182 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnc[nH]2 WXVL_AF0131SC0247 [0,1,1,0,0,0|1,0,1]=4 183 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnc[nH]2 WXVL_AF0131SC0247 [0,1,1,0,0,0|1,0,1]=4 184 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnco2 WXVL_AF0131SC0018 [0,1,1,0,0,0|2,0,0]=4 185 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnco2 WXVL_AF0131SC0018 [0,1,1,0,0,0|2,0,0]=4 186 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cncs2 WXVL_AF0131SC0113 [0,1,1,0,0,0|2,0,0]=4 187 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cncs2 WXVL_AF0131SC0113 [0,1,1,0,0,0|2,0,0]=4 188 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnon2 WXVL_AF0131SC0777 [0,1,1,0,0,0|2,0,0]=4 189 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnon2 WXVL_AF0131SC0777 [0,1,1,0,0,0|2,0,0]=4 190 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnsn2 WXVL_AF0131SC1291 [0,1,1,0,0,0|2,0,0]=4 191 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cnsn2 WXVL_AF0131SC1291 [0,1,1,0,0,0|2,0,0]=4 192 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cocn2 WXVL_AF0131SC0118 [0,1,1,0,0,0|2,0,0]=4 193 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cocn2 WXVL_AF0131SC0118 [0,1,1,0,0,0|2,0,0]=4 194 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cscn2 WXVL_AF0131SC0092 [0,1,1,0,0,0|2,0,0]=4 195 B15R2.402 O=C(Nc1[nH]ncc1Br)c2cscn2 WXVL_AF0131SC0092 [0,1,1,0,0,0|2,0,0]=4 196 B15R2.402 O=C(Nc1[nH]ncc1I)c2c[nH]cn2 WXVL_AF0239SC0074 [0,1,1,0,0,0|1,0,1]=4 197 B15R2.402 O=C(Nc1[nH]ncc1I)c2c[nH]cn2 WXVL_AF0239SC0074 [0,1,1,0,0,0|1,0,1]=4 198 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnc[nH]2 WXVL_AF0239SC0247 [0,1,1,0,0,0|1,0,1]=4 199 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnc[nH]2 WXVL_AF0239SC0247 [0,1,1,0,0,0|1,0,1]=4 200 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnco2 WXVL_AF0239SC0018 [0,1,1,0,0,0|2,0,0]=4 201 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnco2 WXVL_AF0239SC0018 [0,1,1,0,0,0|2,0,0]=4 202 B15R2.402 O=C(Nc1[nH]ncc1I)c2cncs2 WXVL_AF0239SC0113 [0,1,1,0,0,0|2,0,0]=4 203 B15R2.402 O=C(Nc1[nH]ncc1I)c2cncs2 WXVL_AF0239SC0113 [0,1,1,0,0,0|2,0,0]=4 204 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnon2 WXVL_AF0239SC0777 [0,1,1,0,0,0|2,0,0]=4 205 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnon2 WXVL_AF0239SC0777 [0,1,1,0,0,0|2,0,0]=4 206 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnsn2 WXVL_AF0239SC1291 [0,1,1,0,0,0|2,0,0]=4 207 B15R2.402 O=C(Nc1[nH]ncc1I)c2cnsn2 WXVL_AF0239SC1291 [0,1,1,0,0,0|2,0,0]=4 208 B15R2.402 O=C(Nc1[nH]ncc1I)c2cocn2 WXVL_AF0239SC0118 [0,1,1,0,0,0|2,0,0]=4 209 B15R2.402 O=C(Nc1[nH]ncc1I)c2cocn2 WXVL_AF0239SC0118 [0,1,1,0,0,0|2,0,0]=4 210 B15R2.402 O=C(Nc1[nH]ncc1I)c2cscn2 WXVL_AF0239SC0092 [0,1,1,0,0,0|2,0,0]=4 211 B15R2.402 O=C(Nc1[nH]ncc1I)c2cscn2 WXVL_AF0239SC0092 [0,1,1,0,0,0|2,0,0]=4 212 B15R2.410 Cc1n[nH]nc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC00036 [0,1,1,0,0,0|2,0,0]=4 213 B15R2.410 Cc1n[nH]nc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC00036 [0,1,1,0,0,0|2,0,0]=4 214 B15R2.410 Cc1nc[nH]c1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0269 [0,1,1,0,0,0|1,0,1]=4 215 B15R2.410 Cc1nc[nH]c1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0269 [0,1,1,0,0,0|1,0,1]=4 216 B15R2.410 Cc1ncoc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0103 [0,1,1,0,0,0|2,0,0]=4 217 B15R2.410 Cc1ncoc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0103 [0,1,1,0,0,0|2,0,0]=4 218 B15R2.410 Cc1ncsc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0093 [0,1,1,0,0,0|2,0,0]=4 219 B15R2.410 Cc1ncsc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0093 [0,1,1,0,0,0|2,0,0]=4 220 B15R2.410 Cc1ocnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0732 [0,1,1,0,0,0|2,0,0]=4 221 B15R2.410 Cc1ocnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0732 [0,1,1,0,0,0|2,0,0]=4 222 B15R2.410 Cc1scnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0722 [0,1,1,0,0,0|2,0,0]=4 223 B15R2.410 Cc1scnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0722 [0,1,1,0,0,0|2,0,0]=4 224 B15R2.410 Cn1cncc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0099 [0,1,1,0,0,0|1,0,1]=4 225 B15R2.410 Cn1cncc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0099 [0,1,1,0,0,0|1,0,1]=4 226 B15R2.410 Cn1ncnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0037 [0,1,1,0,0,0|2,0,0]=4 227 B15R2.410 Cn1ncnc1C(=O)Nc2ccn[nH]2 WXVL_AF0122SC0037 [0,1,1,0,0,0|2,0,0]=4 228 B15R2.410 O=C(Nc1ccn[nH]1)c2ncsc2Br WXVL_AF0122SC0192 [0,1,1,0,0,0|2,0,0]=4 229 B15R2.410 O=C(Nc1ccn[nH]1)c2ncsc2Br WXVL_AF0122SC0192 [0,1,1,0,0,0|2,0,0]=4 230 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccccn2 WXVL_AF0122SC0058 [0,0,1,0,0,1|2,0,0]=4 231 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccccn2 WXVL_AF0122SC0058 [0,0,1,0,0,1|2,0,0]=4 232 B15R2.1259 O=C(Nc1ccn[nH]1)c2cccnc2 WXVL_AF0122SC0061 [0,0,1,0,0,1|2,0,0]=4 233 B15R2.1259 O=C(Nc1ccn[nH]1)c2cccnc2 WXVL_AF0122SC0061 [0,0,1,0,0,1|2,0,0]=4 234 B15R2.1259 O=C(Nc1ccn[nH]1)c2cccnn2 WXVL_AF0122SC0374 [0,0,1,0,0,1|2,0,0]=4 235 B15R2.1259 O=C(Nc1ccn[nH]1)c2cccnn2 WXVL_AF0122SC0374 [0,0,1,0,0,1|2,0,0]=4 236 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccncc2 WXVL_AF0122SC0062 [0,0,1,0,0,1|2,0,0]=4 237 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccncc2 WXVL_AF0122SC0062 [0,0,1,0,0,1|2,0,0]=4 238 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccncn2 WXVL_AF0122SC0231 [0,0,1,0,0,1|1,0,0]=3 239 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccncn2 WXVL_AF0122SC0231 [0,0,1,0,0,1|1,0,0]=3 240 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccnnc2 WXVL_AF0122SC0064 [0,0,1,0,0,1|2,0,0]=4 241 B15R2.1259 O=C(Nc1ccn[nH]1)c2ccnnc2 WXVL_AF0122SC0064 [0,0,1,0,0,1|2,0,0]=4 242 B15R2.1259 O=C(Nc1ccn[nH]1)c2cncnc2 WXVL_AF0122SC0097 [0,0,1,0,0,1|1,0,0]=3 243 B15R2.1259 O=C(Nc1ccn[nH]1)c2cncnc2 WXVL_AF0122SC0097 [0,0,1,0,0,1|1,0,0]=3 244 B15R2.1259 O=C(Nc1ccn[nH]1)c2ncccn2 WXVL_AF0122SC0096 [0,0,1,0,0,1|2,0,0]=4 245 B15R2.1259 O=C(Nc1ccn[nH]1)c2ncccn2 WXVL_AF0122SC0096 [0,0,1,0,0,1|2,0,0]=4 246 B15R2.1259 O=C(Nc1ccno1)c2ccncn2 WXVL_AF0588SC0231 [0,0,1,0,0,1|2,0,0]=4 247 B15R2.1259 O=C(Nc1ccno1)c2ccncn2 WXVL_AF0588SC0231 [0,0,1,0,0,1|2,0,0]=4 248 B15R2.1259 O=C(Nc1ccno1)c2cncnc2 WXVL_AF0588SC0097 [0,0,1,0,0,1|2,0,0]=4 249 B15R2.1259 O=C(Nc1ccno1)c2cncnc2 WXVL_AF0588SC0097 [0,0,1,0,0,1|2,0,0]=4 250 B15R2.1259 O=C(Nc1ccns1)c2ccncn2 WXVL_AF00325SC0231 [0,0,1,0,0,1|2,0,0]=4 251 B15R2.1259 O=C(Nc1ccns1)c2ccncn2 WXVL_AF00325SC0231 [0,0,1,0,0,1|2,0,0]=4 252 B15R2.1259 O=C(Nc1ccns1)c2cncnc2 WXVL_AF00325SC0097 [0,0,1,0,0,1|2,0,0]=4 253 B15R2.1259 O=C(Nc1ccns1)c2cncnc2 WXVL_AF00325SC0097 [0,0,1,0,0,1|2,0,0]=4 254 B15R2.1260 O=C(Cc1cscn1)Nc2ccn[nH]2 WXVL_AF0122SA0012 [0,0,1,0,0,1|2,0,0]=4 255 B15R2.1260 O=C(Cc1cscn1)Nc2ccn[nH]2 WXVL_AF0122SA0012 [0,0,1,0,0,1|2,0,0]=4 256 B15R2.1260 O=C(Cn1cccn1)Nc2ccn[nH]2 WXVL_AF0122SA0030 [0,0,1,0,0,1|1,0,0]=3 257 B15R2.1260 O=C(Cn1cccn1)Nc2ccn[nH]2 WXVL_AF0122SA0030 [0,0,1,0,0,1|1,0,0]=3 258 B15R2.1260 O=C(Cn1cccn1)Nc2ccno2 WXVL_AF0588SA0030 [0,0,1,0,0,1|2,0,0]=4 259 B15R2.1260 O=C(Cn1cccn1)Nc2ccno2 WXVL_AF0588SA0030 [0,0,1,0,0,1|2,0,0]=4 260 B15R2.1260 O=C(Cn1cccn1)Nc2ccns2 WXVL_AF00325SA0030 [0,0,1,0,0,1|2,0,0]=4 261 B15R2.1260 O=C(Cn1cccn1)Nc2ccns2 WXVL_AF00325SA0030 [0,0,1,0,0,1|2,0,0]=4 262 B15R2.1260 O=C(Cn1ccnc1)Nc2ccn[nH]2 WXVL_AF0122SC0105 [0,0,1,0,0,1|1,0,0]=3 263 B15R2.1260 O=C(Cn1ccnc1)Nc2ccn[nH]2 WXVL_AF0122SC0105 [0,0,1,0,0,1|1,0,0]=3 264 B15R2.1260 O=C(Cn1ccnc1)Nc2ccno2 WXVL_AF0588SC0105 [0,0,1,0,0,1|2,0,0]=4 265 B15R2.1260 O=C(Cn1ccnc1)Nc2ccno2 WXVL_AF0588SC0105 [0,0,1,0,0,1|2,0,0]=4 266 B15R2.1260 O=C(Cn1ccnc1)Nc2ccns2 WXVL_AF00325SC0105 [0,0,1,0,0,1|2,0,0]=4 267 B15R2.1260 O=C(Cn1ccnc1)Nc2ccns2 WXVL_AF00325SC0105 [0,0,1,0,0,1|2,0,0]=4 268 B15R2.1260 O=C(Cn1ccnn1)Nc2ccn[nH]2 WXVL_AF0122SA0035 [0,0,1,0,0,1|2,0,0]=4 269 B15R2.1260 O=C(Cn1ccnn1)Nc2ccn[nH]2 WXVL_AF0122SA0035 [0,0,1,0,0,1|2,0,0]=4 270 B15R2.1260 O=C(Cn1nccn1)Nc2ccn[nH]2 WXVL_AF0122SA0036 [0,0,1,0,0,1|2,0,0]=4 271 B15R2.1260 O=C(Cn1nccn1)Nc2ccn[nH]2 WXVL_AF0122SA0036 [0,0,1,0,0,1|2,0,0]=4 272 B15R2.3989 O=C(NCc1ccn[nH]1)c2c[nH]cn2 WXVL_AK0459SC0074 [0,0,1,0,0,1|1,0,1]=4 273 B15R2.3989 O=C(NCc1ccn[nH]1)c2c[nH]cn2 WXVL_AK0459SC0074 [0,0,1,0,0,1|1,0,1]=4 274 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnc[nH]2 WXVL_AK0459SC0247 [0,0,1,0,0,1|1,0,1]=4 275 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnc[nH]2 WXVL_AK0459SC0247 [0,0,1,0,0,1|1,0,1]=4 276 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnco2 WXVL_AK0459SC0018 [0,0,1,0,0,1|2,0,0]=4 277 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnco2 WXVL_AK0459SC0018 [0,0,1,0,0,1|2,0,0]=4 278 B15R2.3989 O=C(NCc1ccn[nH]1)c2cncs2 WXVL_AK0459SC0113 [0,0,1,0,0,1|2,0,0]=4 279 B15R2.3989 O=C(NCc1ccn[nH]1)c2cncs2 WXVL_AK0459SC0113 [0,0,1,0,0,1|2,0,0]=4 280 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnon2 WXVL_AK0459SC0777 [0,0,1,0,0,1|2,0,0]=4 281 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnon2 WXVL_AK0459SC0777 [0,0,1,0,0,1|2,0,0]=4 282 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnsn2 WXVL_AK0459SC1291 [0,0,1,0,0,1|2,0,0]=4 283 B15R2.3989 O=C(NCc1ccn[nH]1)c2cnsn2 WXVL_AK0459SC1291 [0,0,1,0,0,1|2,0,0]=4 284 B15R2.3989 O=C(NCc1ccn[nH]1)c2cocn2 WXVL_AK0459SC0118 [0,0,1,0,0,1|2,0,0]=4 285 B15R2.3989 O=C(NCc1ccn[nH]1)c2cocn2 WXVL_AK0459SC0118 [0,0,1,0,0,1|2,0,0]=4 286 B15R2.3989 O=C(NCc1ccn[nH]1)c2cscn2 WXVL_AK0459SC0092 [0,0,1,0,0,1|2,0,0]=4 287 B15R2.3989 O=C(NCc1ccn[nH]1)c2cscn2 WXVL_AK0459SC0092 [0,0,1,0,0,1|2,0,0]=4