0 B11R2.2 C1=C(CCC1)c2ccon2 WXVL_LR0685BT0967 [0,0,0,0,0,0|2,0,2]=4 1 B11R2.2 C1=C(CCC1)c2cn[nH]n2 WXVL_LR0395BT0967 [0,0,0,0,0,0|2,0,2]=4 2 B11R2.2 C1=C(CCC1)c2cnoc2 WXVL_LR0706BT0967 [0,0,0,0,0,0|2,0,2]=4 3 B11R2.2 C1=C(CCO1)c2ccon2 WXVL_LR0685BT5753 [0,0,0,0,0,0|2,0,2]=4 4 B11R2.2 C1=C(CCO1)c2cn[nH]n2 WXVL_LR0395BT5753 [0,0,0,0,0,0|2,0,2]=4 5 B11R2.2 C1=C(CCO1)c2cnoc2 WXVL_LR0706BT5753 [0,0,0,0,0,0|2,0,2]=4 6 B11R2.2 C1=C(COC1)c2cccs2 WXVL_LR0498BT1456 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.2 C1=C(COC1)c2ccon2 WXVL_LR0685BT1456 [0,0,0,0,0,0|2,0,2]=4 8 B11R2.2 C1=C(COC1)c2cn[nH]n2 WXVL_LR0395BT1456 [0,0,0,0,0,0|2,0,2]=4 9 B11R2.2 C1=C(COC1)c2cnc[nH]2 WXVL_LR0418BT1456 [0,0,0,0,0,0|3,0,1]=4 10 B11R2.2 C1=C(COC1)c2cnoc2 WXVL_LR0706BT1456 [0,0,0,0,0,0|2,0,2]=4 11 B11R2.2 C1=C(COC1)c2cnsc2 WXVL_LR0652BT1456 [0,0,0,0,0,0|3,0,1]=4 12 B11R2.2 C1=C(COC1)c2nc[nH]n2 WXVL_LR0419BT1456 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.2 c1cc(c[nH]1)c2ccon2 WXVL_LR0685BT5115 [0,0,0,0,0,0|1,0,0]=1 14 B11R2.2 c1cc(c[nH]1)c2cn[nH]n2 WXVL_LR0395BT5115 [0,0,0,0,0,0|1,0,0]=1 15 B11R2.2 c1cc(c[nH]1)c2cnc[nH]2 WXVL_LR0418BT5115 [0,0,0,0,0,0|1,0,1]=2 16 B11R2.2 c1cc(c[nH]1)c2cnoc2 WXVL_LR0706BT5115 [0,0,0,0,0,0|1,0,0]=1 17 B11R2.2 c1cc(c[nH]1)c2cnsc2 WXVL_LR0652BT5115 [0,0,0,0,0,0|1,1,0]=2 18 B11R2.2 c1cc(c[nH]1)c2nc[nH]n2 WXVL_LR0419BT5115 [0,0,0,0,0,0|2,0,1]=3 19 B11R2.2 c1cc(co1)c2ccon2 WXVL_LR0685BT1598 [0,0,0,0,0,0|2,0,0]=2 20 B11R2.2 c1cc(co1)c2cn[nH]n2 WXVL_LR0395BT1598 [0,0,0,0,0,0|2,0,0]=2 21 B11R2.2 c1cc(co1)c2cnoc2 WXVL_LR0706BT1598 [0,0,0,0,0,0|2,0,0]=2 22 B11R2.2 c1cc(co1)c2cnsc2 WXVL_LR0652BT1598 [0,0,0,0,0,0|2,1,0]=3 23 B11R2.2 c1cc(cs1)c2cn[nH]n2 WXVL_LR0395BT1561 [0,0,0,0,0,0|2,0,0]=2 24 B11R2.2 c1cc(cs1)c2cnoc2 WXVL_LR0706BT1561 [0,0,0,0,0,0|2,0,0]=2 25 B11R2.2 c1cc(cs1)c2cnsc2 WXVL_LR0652BT1561 [0,0,0,0,0,0|2,1,0]=3 26 B11R2.2 c1cc(n[nH]1)c2ccon2 WXVL_LR0685BT0902 [0,0,0,0,0,0|2,0,0]=2 27 B11R2.2 c1cc(n[nH]1)c2cn[nH]n2 WXVL_LR0395BT0902 [0,0,0,0,0,0|2,0,0]=2 28 B11R2.2 c1cc(n[nH]1)c2cnc[nH]2 WXVL_LR0418BT0902 [0,0,0,0,0,0|2,0,1]=3 29 B11R2.2 c1cc(n[nH]1)c2cnoc2 WXVL_LR0706BT0902 [0,0,0,0,0,0|2,0,0]=2 30 B11R2.2 c1cc(n[nH]1)c2cnsc2 WXVL_LR0652BT0902 [0,0,0,0,0,0|2,1,0]=3 31 B11R2.2 c1cc(n[nH]1)c2nc[nH]n2 WXVL_LR0419BT0902 [0,0,0,0,0,0|3,0,1]=4 32 B11R2.2 c1cc(no1)c2ccsc2 WXVL_LR0685BT1561 [0,0,0,0,0,0|2,0,0]=2 33 B11R2.2 c1cc(no1)c2cn[nH]c2 WXVL_LR0685BT0829 [0,0,0,0,0,0|2,0,0]=2 34 B11R2.2 c1cc(no1)c2cncs2 WXVL_LR0685BT0771 [0,0,0,0,0,0|2,0,1]=3 35 B11R2.2 c1cc(no1)c2cnoc2 WXVL_LR0685BT1438 [0,0,0,0,0,0|2,0,1]=3 36 B11R2.2 c1cc(no1)c2cscn2 WXVL_LR0685BT0962 [0,0,0,0,0,0|3,0,0]=3 37 B11R2.2 c1coc(c1)c2ccon2 WXVL_LR0685BT1995 [0,0,0,0,0,0|3,0,0]=3 38 B11R2.2 c1coc(c1)c2cn[nH]n2 WXVL_LR0395BT1995 [0,0,0,0,0,0|3,0,0]=3 39 B11R2.2 c1coc(c1)c2cnc[nH]2 WXVL_LR0418BT1995 [0,0,0,0,0,0|3,0,1]=4 40 B11R2.2 c1coc(c1)c2cnoc2 WXVL_LR0706BT1995 [0,0,0,0,0,0|3,0,0]=3 41 B11R2.2 c1coc(c1)c2cnsc2 WXVL_LR0652BT1995 [0,0,0,0,0,0|3,1,0]=4 42 B11R2.2 c1coc(c1)c2ncns2 WXVL_LR0623BT1995 [0,0,0,0,0,0|4,0,0]=4 43 B11R2.2 c1csc(c1)c2cc[nH]c2 WXVL_LR0498BT5115 [0,0,0,0,0,0|3,0,0]=3 44 B11R2.2 c1csc(c1)c2cc[nH]n2 WXVL_LR0498BT0902 [0,0,0,0,0,0|4,0,0]=4 45 B11R2.2 c1csc(c1)c2ccoc2 WXVL_LR0498BT1598 [0,0,0,0,0,0|4,0,0]=4 46 B11R2.2 c1csc(c1)c2ccon2 WXVL_LR0685BT1547 [0,0,0,0,0,0|3,0,0]=3 47 B11R2.2 c1csc(c1)c2ccon2 WXVL_LR0685BT4023 [0,0,0,0,0,0|3,0,0]=3 48 B11R2.2 c1csc(c1)c2ccon2 WXVL_LR0685BT5079 [0,0,0,0,0,0|3,0,0]=3 49 B11R2.2 c1csc(c1)c2ccsc2 WXVL_LR0498BT1561 [0,0,0,0,0,0|4,0,0]=4 50 B11R2.2 c1csc(c1)c2cn[nH]c2 WXVL_LR0498BT0829 [0,0,0,0,0,0|4,0,0]=4 51 B11R2.2 c1csc(c1)c2cn[nH]n2 WXVL_LR0395BT1547 [0,0,0,0,0,0|3,0,0]=3 52 B11R2.2 c1csc(c1)c2cn[nH]n2 WXVL_LR0395BT4023 [0,0,0,0,0,0|3,0,0]=3 53 B11R2.2 c1csc(c1)c2cn[nH]n2 WXVL_LR0395BT5079 [0,0,0,0,0,0|3,0,0]=3 54 B11R2.2 c1csc(c1)c2cnc[nH]2 WXVL_LR0418BT1547 [0,0,0,0,0,0|3,0,1]=4 55 B11R2.2 c1csc(c1)c2cnc[nH]2 WXVL_LR0418BT4023 [0,0,0,0,0,0|3,0,1]=4 56 B11R2.2 c1csc(c1)c2cnc[nH]2 WXVL_LR0418BT5079 [0,0,0,0,0,0|3,0,1]=4 57 B11R2.2 c1csc(c1)c2cncs2 WXVL_LR0498BT0771 [0,0,0,0,0,0|4,0,0]=4 58 B11R2.2 c1csc(c1)c2cnoc2 WXVL_LR0498BT1438 [0,0,0,0,0,0|3,0,0]=3 59 B11R2.2 c1csc(c1)c2cnoc2 WXVL_LR0706BT1547 [0,0,0,0,0,0|3,0,0]=3 60 B11R2.2 c1csc(c1)c2cnoc2 WXVL_LR0706BT4023 [0,0,0,0,0,0|3,0,0]=3 61 B11R2.2 c1csc(c1)c2cnoc2 WXVL_LR0706BT5079 [0,0,0,0,0,0|3,0,0]=3 62 B11R2.2 c1csc(c1)c2cnsc2 WXVL_LR0652BT1547 [0,0,0,0,0,0|3,1,0]=4 63 B11R2.2 c1csc(c1)c2cnsc2 WXVL_LR0652BT4023 [0,0,0,0,0,0|3,1,0]=4 64 B11R2.2 c1csc(c1)c2cnsc2 WXVL_LR0652BT5079 [0,0,0,0,0,0|3,1,0]=4 65 B11R2.2 c1csc(c1)c2cscn2 WXVL_LR0498BT0962 [0,0,0,0,0,0|4,0,0]=4 66 B11R2.2 c1csc(c1)c2ncns2 WXVL_LR0623BT1547 [0,0,0,0,0,0|4,0,0]=4 67 B11R2.2 c1csc(c1)c2ncns2 WXVL_LR0623BT4023 [0,0,0,0,0,0|4,0,0]=4 68 B11R2.2 c1csc(c1)c2ncns2 WXVL_LR0623BT5079 [0,0,0,0,0,0|4,0,0]=4 69 B11R2.2 c1csc(n1)c2ccon2 WXVL_LR0685BT2077 [0,0,0,0,0,0|4,0,0]=4 70 B11R2.2 c1csc(n1)c2cn[nH]n2 WXVL_LR0395BT2077 [0,0,0,0,0,0|4,0,0]=4 71 B11R2.2 c1csc(n1)c2cnoc2 WXVL_LR0706BT2077 [0,0,0,0,0,0|4,0,0]=4 72 B11R2.2 c1n[nH]cc1c2cn[nH]n2 WXVL_LR0395BT0829 [0,0,0,0,0,0|2,0,0]=2 73 B11R2.2 c1n[nH]cc1c2cnoc2 WXVL_LR0706BT0829 [0,0,0,0,0,0|2,0,0]=2 74 B11R2.2 c1n[nH]cc1c2cnsc2 WXVL_LR0652BT0829 [0,0,0,0,0,0|2,1,0]=3 75 B11R2.2 c1nc(cs1)c2cn[nH]n2 WXVL_LR0395BT0962 [0,0,0,0,0,0|3,0,0]=3 76 B11R2.2 c1nc(cs1)c2cnoc2 WXVL_LR0706BT0962 [0,0,0,0,0,0|3,0,0]=3 77 B11R2.2 c1nc(cs1)c2cnsc2 WXVL_LR0652BT0962 [0,0,0,0,0,0|3,0,1]=4 78 B11R2.2 c1nc(n[nH]1)c2ccoc2 WXVL_LR0419BT1598 [0,0,0,0,0,0|3,0,1]=4 79 B11R2.2 c1nc(n[nH]1)c2ccsc2 WXVL_LR0419BT1561 [0,0,0,0,0,0|3,0,1]=4 80 B11R2.2 c1nc(n[nH]1)c2cn[nH]c2 WXVL_LR0419BT0829 [0,0,0,0,0,0|3,0,1]=4 81 B11R2.2 c1nc(n[nH]1)c2cncs2 WXVL_LR0419BT0771 [0,0,0,0,0,0|4,0,0]=4 82 B11R2.2 c1nc(n[nH]1)c2cnoc2 WXVL_LR0419BT1438 [0,0,0,0,0,0|3,0,0]=3 83 B11R2.2 c1nc(n[nH]1)c2cscn2 WXVL_LR0419BT0962 [0,0,0,0,0,0|4,0,0]=4 84 B11R2.2 c1ncc([nH]1)c2ccoc2 WXVL_LR0418BT1598 [0,0,0,0,0,0|2,0,1]=3 85 B11R2.2 c1ncc([nH]1)c2ccsc2 WXVL_LR0418BT1561 [0,0,0,0,0,0|2,0,1]=3 86 B11R2.2 c1ncc([nH]1)c2cn[nH]c2 WXVL_LR0418BT0829 [0,0,0,0,0,0|2,0,1]=3 87 B11R2.2 c1ncc([nH]1)c2cncs2 WXVL_LR0418BT0771 [0,0,0,0,0,0|2,0,2]=4 88 B11R2.2 c1ncc([nH]1)c2cnoc2 WXVL_LR0418BT1438 [0,0,0,0,0,0|2,0,1]=3 89 B11R2.2 c1ncc([nH]1)c2cscn2 WXVL_LR0418BT0962 [0,0,0,0,0,0|3,0,1]=4 90 B11R2.2 c1ncc(s1)c2cn[nH]n2 WXVL_LR0395BT0771 [0,0,0,0,0,0|2,0,1]=3 91 B11R2.2 c1ncc(s1)c2cnoc2 WXVL_LR0706BT0771 [0,0,0,0,0,0|2,0,1]=3 92 B11R2.2 c1ncc(s1)c2cnsc2 WXVL_LR0652BT0771 [0,0,0,0,0,0|2,1,1]=4 93 B11R2.2 c1nocc1c2cn[nH]n2 WXVL_LR0395BT1438 [0,0,0,0,0,0|2,0,1]=3 94 B11R2.2 c1nocc1c2cnoc2 WXVL_LR0706BT1438 [0,0,0,0,0,0|2,0,1]=3 95 B11R2.2 c1nocc1c2cnsc2 WXVL_LR0652BT1438 [0,0,0,0,0,0|2,0,1]=3 96 B11R2.2 c1nsc(n1)c2cc[nH]c2 WXVL_LR0623BT5115 [0,0,0,0,0,0|2,0,0]=2 97 B11R2.2 c1nsc(n1)c2cc[nH]n2 WXVL_LR0623BT0902 [0,0,0,0,0,0|3,0,0]=3 98 B11R2.2 c1nsc(n1)c2ccoc2 WXVL_LR0623BT1598 [0,0,0,0,0,0|3,0,0]=3 99 B11R2.2 c1nsc(n1)c2ccsc2 WXVL_LR0623BT1561 [0,0,0,0,0,0|3,0,0]=3 100 B11R2.2 c1nsc(n1)c2cn[nH]c2 WXVL_LR0623BT0829 [0,0,0,0,0,0|3,0,0]=3 101 B11R2.2 c1nsc(n1)c2cncs2 WXVL_LR0623BT0771 [0,0,0,0,0,0|3,0,1]=4 102 B11R2.2 c1nsc(n1)c2cnoc2 WXVL_LR0623BT1438 [0,0,0,0,0,0|3,0,1]=4 103 B11R2.2 c1nsc(n1)c2cscn2 WXVL_LR0623BT0962 [0,0,0,0,0,0|4,0,0]=4 104 B12R2.6 Cc1cc(cs1)c2ccon2 WXVL_LR0685BT9786 [0,1,0,0,0,0|2,0,0]=3 105 B12R2.6 Cc1cc(cs1)c2cn[nH]n2 WXVL_LR0395BT9786 [0,1,0,0,0,0|2,0,0]=3 106 B12R2.6 Cc1cc(cs1)c2cnc[nH]2 WXVL_LR0418BT9786 [0,1,0,0,0,0|2,0,1]=4 107 B12R2.6 Cc1cc(cs1)c2cnoc2 WXVL_LR0706BT9786 [0,1,0,0,0,0|2,0,0]=3 108 B12R2.6 Cc1cc(cs1)c2cnsc2 WXVL_LR0652BT9786 [0,1,0,0,0,0|2,1,0]=4 109 B12R2.6 Cc1cc(cs1)c2ncns2 WXVL_LR0623BT9786 [0,1,0,0,0,0|3,0,0]=4 110 B12R2.6 Cc1cc(n[nH]1)c2ccon2 WXVL_LR0685BT1880 [0,1,0,0,0,0|2,0,0]=3 111 B12R2.6 Cc1cc(n[nH]1)c2cn[nH]n2 WXVL_LR0395BT1880 [0,1,0,0,0,0|2,0,0]=3 112 B12R2.6 Cc1cc(n[nH]1)c2cnc[nH]2 WXVL_LR0418BT1880 [0,1,0,0,0,0|2,0,1]=4 113 B12R2.6 Cc1cc(n[nH]1)c2cnoc2 WXVL_LR0706BT1880 [0,1,0,0,0,0|2,0,0]=3 114 B12R2.6 Cc1cc(n[nH]1)c2cnsc2 WXVL_LR0652BT1880 [0,1,0,0,0,0|2,1,0]=4 115 B12R2.6 Cc1cc(n[nH]1)c2ncns2 WXVL_LR0623BT1880 [0,1,0,0,0,0|3,0,0]=4 116 B12R2.6 Cc1ccc(o1)c2ccon2 WXVL_LR0685BT2297 [0,1,0,0,0,0|3,0,0]=4 117 B12R2.6 Cc1ccc(o1)c2cn[nH]n2 WXVL_LR0395BT2297 [0,1,0,0,0,0|3,0,0]=4 118 B12R2.6 Cc1ccc(o1)c2cnoc2 WXVL_LR0706BT2297 [0,1,0,0,0,0|3,0,0]=4 119 B12R2.6 Cc1ccc(s1)c2cc[nH]c2 WXVL_LR0501BT5115 [0,1,0,0,0,0|3,0,0]=4 120 B12R2.6 Cc1ccc(s1)c2cnoc2 WXVL_LR0501BT1438 [0,1,0,0,0,0|3,0,0]=4 121 B12R2.6 Cc1cnc([nH]1)c2cc[nH]c2 WXVL_LR1156BT5115 [0,1,0,0,0,0|3,0,0]=4 122 B12R2.6 Cc1csc(c1)c2ccon2 WXVL_LR0685BT2315 [0,1,0,0,0,0|3,0,0]=4 123 B12R2.6 Cc1csc(c1)c2cn[nH]n2 WXVL_LR0395BT2315 [0,1,0,0,0,0|3,0,0]=4 124 B12R2.6 Cc1csc(c1)c2cnoc2 WXVL_LR0706BT2315 [0,1,0,0,0,0|3,0,0]=4 125 B12R2.6 Cc1nc(no1)c2cc[nH]c2 WXVL_LR0423BT5115 [0,1,0,0,0,0|2,0,0]=3 126 B12R2.6 Cc1nc(no1)c2cc[nH]n2 WXVL_LR0423BT0902 [0,1,0,0,0,0|3,0,0]=4 127 B12R2.6 Cc1nc(no1)c2ccoc2 WXVL_LR0423BT1598 [0,1,0,0,0,0|3,0,0]=4 128 B12R2.6 Cc1nc(no1)c2ccsc2 WXVL_LR0423BT1561 [0,1,0,0,0,0|3,0,0]=4 129 B12R2.6 Cc1nc(no1)c2cn[nH]c2 WXVL_LR0423BT0829 [0,1,0,0,0,0|3,0,0]=4 130 B12R2.6 Cc1ncc(s1)c2cc[nH]c2 WXVL_LR0558BT5115 [0,1,0,0,0,0|2,0,0]=3 131 B12R2.6 Cc1ncc(s1)c2cc[nH]n2 WXVL_LR0558BT0902 [0,1,0,0,0,0|3,0,0]=4 132 B12R2.6 Cc1ncc(s1)c2ccoc2 WXVL_LR0558BT1598 [0,1,0,0,0,0|3,0,0]=4 133 B12R2.6 Cc1ncc(s1)c2ccon2 WXVL_LR0685BT2292 [0,1,0,0,0,0|2,0,1]=4 134 B12R2.6 Cc1ncc(s1)c2ccsc2 WXVL_LR0558BT1561 [0,1,0,0,0,0|3,0,0]=4 135 B12R2.6 Cc1ncc(s1)c2cn[nH]c2 WXVL_LR0558BT0829 [0,1,0,0,0,0|3,0,0]=4 136 B12R2.6 Cc1ncc(s1)c2cn[nH]n2 WXVL_LR0395BT2292 [0,1,0,0,0,0|2,0,1]=4 137 B12R2.6 Cc1ncc(s1)c2cnoc2 WXVL_LR0558BT1438 [0,1,0,0,0,0|2,0,1]=4 138 B12R2.6 Cc1ncc(s1)c2cnoc2 WXVL_LR0706BT2292 [0,1,0,0,0,0|2,0,1]=4 139 B12R2.6 Cc1nnc(o1)c2cc[nH]c2 WXVL_LR0506BT5115 [0,1,0,0,0,0|3,0,0]=4 140 B12R2.6 Clc1cc(cs1)C2=CCOC2 WXVL_LR0844BT1456 [0,1,0,0,0,0|3,0,0]=4 141 B12R2.6 Clc1cc(cs1)c2cc[nH]c2 WXVL_LR0844BT5115 [0,1,0,0,0,0|2,1,0]=4 142 B12R2.6 Clc1cc(cs1)c2cc[nH]n2 WXVL_LR0844BT0902 [0,1,0,0,0,0|3,0,0]=4 143 B12R2.6 Clc1cc(cs1)c2ccoc2 WXVL_LR0844BT1598 [0,1,0,0,0,0|3,0,0]=4 144 B12R2.6 Clc1cc(cs1)c2cn[nH]c2 WXVL_LR0844BT0829 [0,1,0,0,0,0|3,0,0]=4 145 B12R2.6 Clc1cc(cs1)c2cncs2 WXVL_LR0844BT0771 [0,1,0,0,0,0|3,0,0]=4 146 B12R2.6 Clc1cc(cs1)c2cnoc2 WXVL_LR0844BT1438 [0,1,0,0,0,0|2,0,0]=3 147 B12R2.6 Clc1cc(cs1)c2cscn2 WXVL_LR0844BT0962 [0,1,0,0,0,0|3,0,0]=4 148 B12R2.6 Clc1ccc(s1)c2cc[nH]c2 WXVL_LR0493BT5115 [0,1,0,0,0,0|3,0,0]=4 149 B12R2.6 Clc1ccc(s1)c2cnoc2 WXVL_LR0493BT1438 [0,1,0,0,0,0|3,0,0]=4 150 B12R2.6 Clc1csc(n1)c2cc[nH]c2 WXVL_LR1009BT5115 [0,1,0,0,0,0|3,0,0]=4 151 B12R2.6 Clc1ncc(s1)c2cc[nH]c2 WXVL_LR1248BT5115 [0,1,0,0,0,0|2,0,0]=3 152 B12R2.6 Clc1ncc(s1)c2cc[nH]n2 WXVL_LR1248BT0902 [0,1,0,0,0,0|3,0,0]=4 153 B12R2.6 Clc1ncc(s1)c2ccoc2 WXVL_LR1248BT1598 [0,1,0,0,0,0|3,0,0]=4 154 B12R2.6 Clc1ncc(s1)c2ccsc2 WXVL_LR1248BT1561 [0,1,0,0,0,0|3,0,0]=4 155 B12R2.6 Clc1ncc(s1)c2cn[nH]c2 WXVL_LR1248BT0829 [0,1,0,0,0,0|3,0,0]=4 156 B12R2.6 Clc1ncc(s1)c2cnoc2 WXVL_LR1248BT1438 [0,1,0,0,0,0|2,0,1]=4 157 B12R2.6 Cn1cc(cn1)C2=CCOC2 WXVL_LR0394BT1456 [0,1,0,0,0,0|3,0,0]=4 158 B12R2.6 Cn1cc(cn1)c2cc[nH]c2 WXVL_LR0394BT5115 [0,1,0,0,0,0|2,0,0]=3 159 B12R2.6 Cn1cc(cn1)c2cc[nH]n2 WXVL_LR0394BT0902 [0,1,0,0,0,0|3,0,0]=4 160 B12R2.6 Cn1cc(cn1)c2ccoc2 WXVL_LR0394BT1598 [0,1,0,0,0,0|3,0,0]=4 161 B12R2.6 Cn1cc(cn1)c2ccon2 WXVL_LR0685BT0701 [0,1,0,0,0,0|2,0,0]=3 162 B12R2.6 Cn1cc(cn1)c2ccon2 WXVL_LR0685BT1710 [0,1,0,0,0,0|2,0,0]=3 163 B12R2.6 Cn1cc(cn1)c2ccsc2 WXVL_LR0394BT1561 [0,1,0,0,0,0|3,0,0]=4 164 B12R2.6 Cn1cc(cn1)c2cn[nH]c2 WXVL_LR0394BT0829 [0,1,0,0,0,0|3,0,0]=4 165 B12R2.6 Cn1cc(cn1)c2cn[nH]n2 WXVL_LR0395BT0701 [0,1,0,0,0,0|2,0,0]=3 166 B12R2.6 Cn1cc(cn1)c2cn[nH]n2 WXVL_LR0395BT1710 [0,1,0,0,0,0|2,0,0]=3 167 B12R2.6 Cn1cc(cn1)c2cnc[nH]2 WXVL_LR0418BT0701 [0,1,0,0,0,0|2,0,1]=4 168 B12R2.6 Cn1cc(cn1)c2cnc[nH]2 WXVL_LR0418BT1710 [0,1,0,0,0,0|2,0,1]=4 169 B12R2.6 Cn1cc(cn1)c2cncs2 WXVL_LR0394BT0771 [0,1,0,0,0,0|3,0,0]=4 170 B12R2.6 Cn1cc(cn1)c2cnoc2 WXVL_LR0394BT1438 [0,1,0,0,0,0|2,0,0]=3 171 B12R2.6 Cn1cc(cn1)c2cnoc2 WXVL_LR0706BT0701 [0,1,0,0,0,0|2,0,0]=3 172 B12R2.6 Cn1cc(cn1)c2cnoc2 WXVL_LR0706BT1710 [0,1,0,0,0,0|2,0,0]=3 173 B12R2.6 Cn1cc(cn1)c2cnsc2 WXVL_LR0652BT0701 [0,1,0,0,0,0|2,1,0]=4 174 B12R2.6 Cn1cc(cn1)c2cnsc2 WXVL_LR0652BT1710 [0,1,0,0,0,0|2,1,0]=4 175 B12R2.6 Cn1cc(cn1)c2cscn2 WXVL_LR0394BT0962 [0,1,0,0,0,0|3,0,0]=4 176 B12R2.6 Cn1cc(cn1)c2ncns2 WXVL_LR0623BT0701 [0,1,0,0,0,0|3,0,0]=4 177 B12R2.6 Cn1cc(cn1)c2ncns2 WXVL_LR0623BT1710 [0,1,0,0,0,0|3,0,0]=4 178 B12R2.6 Cn1cc(nn1)c2cc[nH]c2 WXVL_LR0761BT5115 [0,1,0,0,0,0|1,0,1]=3 179 B12R2.6 Cn1cc(nn1)c2cc[nH]n2 WXVL_LR0761BT0902 [0,1,0,0,0,0|2,0,1]=4 180 B12R2.6 Cn1cc(nn1)c2ccoc2 WXVL_LR0761BT1598 [0,1,0,0,0,0|2,0,1]=4 181 B12R2.6 Cn1cc(nn1)c2ccsc2 WXVL_LR0761BT1561 [0,1,0,0,0,0|2,0,1]=4 182 B12R2.6 Cn1cc(nn1)c2cn[nH]c2 WXVL_LR0761BT0829 [0,1,0,0,0,0|2,0,1]=4 183 B12R2.6 Cn1cc(nn1)c2cnoc2 WXVL_LR0761BT1438 [0,1,0,0,0,0|3,0,0]=4 184 B12R2.6 Cn1ccc(c1)c2cccs2 WXVL_LR0498BT5755 [0,1,0,0,0,0|3,0,0]=4 185 B12R2.6 Cn1ccc(c1)c2ccon2 WXVL_LR0685BT5755 [0,1,0,0,0,0|1,0,0]=2 186 B12R2.6 Cn1ccc(c1)c2cn[nH]n2 WXVL_LR0395BT5755 [0,1,0,0,0,0|1,0,0]=2 187 B12R2.6 Cn1ccc(c1)c2cnc[nH]2 WXVL_LR0418BT5755 [0,1,0,0,0,0|1,0,1]=3 188 B12R2.6 Cn1ccc(c1)c2cnoc2 WXVL_LR0706BT5755 [0,1,0,0,0,0|1,0,0]=2 189 B12R2.6 Cn1ccc(c1)c2cnsc2 WXVL_LR0652BT5755 [0,1,0,0,0,0|1,1,0]=3 190 B12R2.6 Cn1ccc(c1)c2nc[nH]n2 WXVL_LR0419BT5755 [0,1,0,0,0,0|2,0,1]=4 191 B12R2.6 Cn1ccc(c1)c2ncns2 WXVL_LR0623BT5755 [0,1,0,0,0,0|2,0,0]=3 192 B12R2.6 Cn1ccc(n1)c2ccon2 WXVL_LR0685BT1862 [0,1,0,0,0,0|2,0,0]=3 193 B12R2.6 Cn1ccc(n1)c2cn[nH]n2 WXVL_LR0395BT1862 [0,1,0,0,0,0|2,0,0]=3 194 B12R2.6 Cn1ccc(n1)c2cnc[nH]2 WXVL_LR0418BT1862 [0,1,0,0,0,0|2,0,1]=4 195 B12R2.6 Cn1ccc(n1)c2cnoc2 WXVL_LR0706BT1862 [0,1,0,0,0,0|2,0,0]=3 196 B12R2.6 Cn1ccc(n1)c2cnsc2 WXVL_LR0652BT1862 [0,1,0,0,0,0|2,1,0]=4 197 B12R2.6 Cn1ccc(n1)c2ncns2 WXVL_LR0623BT1862 [0,1,0,0,0,0|3,0,0]=4 198 B12R2.6 Cn1cnc(n1)c2cc[nH]c2 WXVL_LR0383BT5115 [0,1,0,0,0,0|2,0,1]=4 199 B12R2.6 Cn1cnc(n1)c2cnoc2 WXVL_LR0383BT1438 [0,1,0,0,0,0|3,0,0]=4 200 B12R2.6 Cn1nnc(n1)c2cc[nH]c2 WXVL_LR1548BT5115 [0,1,0,0,0,0|2,0,0]=3 201 B12R2.6 Cn1nnc(n1)c2cc[nH]n2 WXVL_LR1548BT0902 [0,1,0,0,0,0|3,0,0]=4 202 B12R2.6 Cn1nnc(n1)c2ccoc2 WXVL_LR1548BT1598 [0,1,0,0,0,0|3,0,0]=4 203 B12R2.6 Cn1nnc(n1)c2ccsc2 WXVL_LR1548BT1561 [0,1,0,0,0,0|3,0,0]=4 204 B12R2.6 Cn1nnc(n1)c2cn[nH]c2 WXVL_LR1548BT0829 [0,1,0,0,0,0|3,0,0]=4 205 B12R2.6 Fc1ccc(s1)c2ccon2 WXVL_LR0685BT2581 [0,1,0,0,0,0|3,0,0]=4 206 B12R2.6 Fc1ccc(s1)c2cn[nH]n2 WXVL_LR0395BT2581 [0,1,0,0,0,0|3,0,0]=4 207 B12R2.6 Fc1ccc(s1)c2cnoc2 WXVL_LR0706BT2581 [0,1,0,0,0,0|3,0,0]=4 208 B12R2.6 Fc1cnc(s1)c2cc[nH]c2 WXVL_LR1252BT5115 [0,1,0,0,0,0|3,0,0]=4 209 B12R2.10 Cc1ccsc1c2cc[nH]c2 WXVL_LR0502BT5115 [0,1,0,0,0,0|3,0,0]=4 210 B12R2.10 Cc1ccsc1c2ccon2 WXVL_LR0685BT1652 [0,1,0,0,0,0|3,0,0]=4 211 B12R2.10 Cc1ccsc1c2cn[nH]n2 WXVL_LR0395BT1652 [0,1,0,0,0,0|3,0,0]=4 212 B12R2.10 Cc1ccsc1c2cnoc2 WXVL_LR0502BT1438 [0,1,0,0,0,0|3,0,0]=4 213 B12R2.10 Cc1ccsc1c2cnoc2 WXVL_LR0706BT1652 [0,1,0,0,0,0|3,0,0]=4 214 B12R2.10 Cc1cscc1C2=CCOC2 WXVL_LR0489BT1456 [0,1,0,0,0,0|3,0,0]=4 215 B12R2.10 Cc1cscc1c2cc[nH]c2 WXVL_LR0489BT5115 [0,1,0,0,0,0|2,1,0]=4 216 B12R2.10 Cc1cscc1c2cc[nH]n2 WXVL_LR0489BT0902 [0,1,0,0,0,0|3,0,0]=4 217 B12R2.10 Cc1cscc1c2ccoc2 WXVL_LR0489BT1598 [0,1,0,0,0,0|3,0,0]=4 218 B12R2.10 Cc1cscc1c2ccon2 WXVL_LR0685BT0862 [0,1,0,0,0,0|2,0,0]=3 219 B12R2.10 Cc1cscc1c2ccon2 WXVL_LR0685BT0877 [0,1,0,0,0,0|2,0,0]=3 220 B12R2.10 Cc1cscc1c2cn[nH]c2 WXVL_LR0489BT0829 [0,1,0,0,0,0|3,0,0]=4 221 B12R2.10 Cc1cscc1c2cn[nH]n2 WXVL_LR0395BT0862 [0,1,0,0,0,0|2,0,0]=3 222 B12R2.10 Cc1cscc1c2cn[nH]n2 WXVL_LR0395BT0877 [0,1,0,0,0,0|2,0,0]=3 223 B12R2.10 Cc1cscc1c2cnc[nH]2 WXVL_LR0418BT0862 [0,1,0,0,0,0|2,0,1]=4 224 B12R2.10 Cc1cscc1c2cnc[nH]2 WXVL_LR0418BT0877 [0,1,0,0,0,0|2,0,1]=4 225 B12R2.10 Cc1cscc1c2cncs2 WXVL_LR0489BT0771 [0,1,0,0,0,0|3,0,0]=4 226 B12R2.10 Cc1cscc1c2cnoc2 WXVL_LR0489BT1438 [0,1,0,0,0,0|2,0,0]=3 227 B12R2.10 Cc1cscc1c2cnoc2 WXVL_LR0706BT0862 [0,1,0,0,0,0|2,0,0]=3 228 B12R2.10 Cc1cscc1c2cnoc2 WXVL_LR0706BT0877 [0,1,0,0,0,0|2,0,0]=3 229 B12R2.10 Cc1cscc1c2cnsc2 WXVL_LR0652BT0862 [0,1,0,0,0,0|2,1,0]=4 230 B12R2.10 Cc1cscc1c2cnsc2 WXVL_LR0652BT0877 [0,1,0,0,0,0|2,1,0]=4 231 B12R2.10 Cc1cscc1c2cscn2 WXVL_LR0489BT0962 [0,1,0,0,0,0|3,0,0]=4 232 B12R2.10 Cc1cscc1c2ncns2 WXVL_LR0623BT0862 [0,1,0,0,0,0|3,0,0]=4 233 B12R2.10 Cc1cscc1c2ncns2 WXVL_LR0623BT0877 [0,1,0,0,0,0|3,0,0]=4 234 B12R2.10 Cc1n[nH]cc1c2ccon2 WXVL_LR0685BT2283 [0,1,0,0,0,0|2,0,0]=3 235 B12R2.10 Cc1n[nH]cc1c2cn[nH]n2 WXVL_LR0395BT2283 [0,1,0,0,0,0|2,0,0]=3 236 B12R2.10 Cc1n[nH]cc1c2cnc[nH]2 WXVL_LR0418BT2283 [0,1,0,0,0,0|2,0,1]=4 237 B12R2.10 Cc1n[nH]cc1c2cnoc2 WXVL_LR0706BT2283 [0,1,0,0,0,0|2,0,0]=3 238 B12R2.10 Cc1n[nH]cc1c2cnsc2 WXVL_LR0652BT2283 [0,1,0,0,0,0|2,1,0]=4 239 B12R2.10 Cc1n[nH]cc1c2ncns2 WXVL_LR0623BT2283 [0,1,0,0,0,0|3,0,0]=4 240 B12R2.10 Cc1ncsc1c2cc[nH]c2 WXVL_LR0791BT5115 [0,1,0,0,0,0|2,0,0]=3 241 B12R2.10 Cc1ncsc1c2cc[nH]n2 WXVL_LR0791BT0902 [0,1,0,0,0,0|3,0,0]=4 242 B12R2.10 Cc1ncsc1c2ccoc2 WXVL_LR0791BT1598 [0,1,0,0,0,0|3,0,0]=4 243 B12R2.10 Cc1ncsc1c2ccsc2 WXVL_LR0791BT1561 [0,1,0,0,0,0|3,0,0]=4 244 B12R2.10 Cc1ncsc1c2cn[nH]c2 WXVL_LR0791BT0829 [0,1,0,0,0,0|3,0,0]=4 245 B12R2.10 Cc1ncsc1c2cnoc2 WXVL_LR0791BT1438 [0,1,0,0,0,0|2,0,1]=4 246 B12R2.10 Cc1nocc1c2cccs2 WXVL_LR0498BT0436 [0,1,0,0,0,0|3,0,0]=4 247 B12R2.10 Cc1nocc1c2cccs2 WXVL_LR0498BT2400 [0,1,0,0,0,0|3,0,0]=4 248 B12R2.10 Cc1nocc1c2ccon2 WXVL_LR0685BT0436 [0,1,0,0,0,0|2,0,1]=4 249 B12R2.10 Cc1nocc1c2ccon2 WXVL_LR0685BT2400 [0,1,0,0,0,0|2,0,1]=4 250 B12R2.10 Cc1nocc1c2cn[nH]n2 WXVL_LR0395BT0436 [0,1,0,0,0,0|2,0,1]=4 251 B12R2.10 Cc1nocc1c2cn[nH]n2 WXVL_LR0395BT2400 [0,1,0,0,0,0|2,0,1]=4 252 B12R2.10 Cc1nocc1c2cnc[nH]2 WXVL_LR0418BT0436 [0,1,0,0,0,0|2,0,1]=4 253 B12R2.10 Cc1nocc1c2cnc[nH]2 WXVL_LR0418BT2400 [0,1,0,0,0,0|2,0,1]=4 254 B12R2.10 Cc1nocc1c2cnoc2 WXVL_LR0706BT0436 [0,1,0,0,0,0|2,0,1]=4 255 B12R2.10 Cc1nocc1c2cnoc2 WXVL_LR0706BT2400 [0,1,0,0,0,0|2,0,1]=4 256 B12R2.10 Cc1nocc1c2cnsc2 WXVL_LR0652BT0436 [0,1,0,0,0,0|2,0,1]=4 257 B12R2.10 Cc1nocc1c2cnsc2 WXVL_LR0652BT2400 [0,1,0,0,0,0|2,0,1]=4 258 B12R2.10 Cc1nocc1c2nc[nH]n2 WXVL_LR0419BT0436 [0,1,0,0,0,0|3,0,0]=4 259 B12R2.10 Cc1nocc1c2nc[nH]n2 WXVL_LR0419BT2400 [0,1,0,0,0,0|3,0,0]=4 260 B12R2.10 Cc1oncc1c2cc[nH]c2 WXVL_LR0715BT5115 [0,1,0,0,0,0|1,0,0]=2 261 B12R2.10 Cc1oncc1c2cc[nH]n2 WXVL_LR0715BT0902 [0,1,0,0,0,0|2,0,0]=3 262 B12R2.10 Cc1oncc1c2ccco2 WXVL_LR0715BT1995 [0,1,0,0,0,0|3,0,0]=4 263 B12R2.10 Cc1oncc1c2cccs2 WXVL_LR0498BT1925 [0,1,0,0,0,0|3,0,0]=4 264 B12R2.10 Cc1oncc1c2cccs2 WXVL_LR0715BT1547 [0,1,0,0,0,0|3,0,0]=4 265 B12R2.10 Cc1oncc1c2cccs2 WXVL_LR0715BT4023 [0,1,0,0,0,0|3,0,0]=4 266 B12R2.10 Cc1oncc1c2cccs2 WXVL_LR0715BT5079 [0,1,0,0,0,0|3,0,0]=4 267 B12R2.10 Cc1oncc1c2ccoc2 WXVL_LR0715BT1598 [0,1,0,0,0,0|2,0,0]=3 268 B12R2.10 Cc1oncc1c2ccon2 WXVL_LR0685BT1925 [0,1,0,0,0,0|2,0,1]=4 269 B12R2.10 Cc1oncc1c2ccsc2 WXVL_LR0715BT1561 [0,1,0,0,0,0|2,0,0]=3 270 B12R2.10 Cc1oncc1c2cn[nH]c2 WXVL_LR0715BT0829 [0,1,0,0,0,0|2,0,0]=3 271 B12R2.10 Cc1oncc1c2cn[nH]n2 WXVL_LR0395BT1925 [0,1,0,0,0,0|2,0,1]=4 272 B12R2.10 Cc1oncc1c2cnc[nH]2 WXVL_LR0418BT1925 [0,1,0,0,0,0|2,0,1]=4 273 B12R2.10 Cc1oncc1c2cncs2 WXVL_LR0715BT0771 [0,1,0,0,0,0|2,0,1]=4 274 B12R2.10 Cc1oncc1c2cnoc2 WXVL_LR0706BT1925 [0,1,0,0,0,0|2,0,1]=4 275 B12R2.10 Cc1oncc1c2cnoc2 WXVL_LR0715BT1438 [0,1,0,0,0,0|2,0,1]=4 276 B12R2.10 Cc1oncc1c2cnsc2 WXVL_LR0652BT1925 [0,1,0,0,0,0|2,0,1]=4 277 B12R2.10 Cc1oncc1c2cscn2 WXVL_LR0715BT0962 [0,1,0,0,0,0|3,0,0]=4 278 B12R2.10 Cc1oncc1c2nc[nH]n2 WXVL_LR0419BT1925 [0,1,0,0,0,0|3,0,0]=4 279 B12R2.10 Clc1ccsc1c2cc[nH]c2 WXVL_LR0754BT5115 [0,1,0,0,0,0|3,0,0]=4 280 B12R2.10 Clc1ccsc1c2cnoc2 WXVL_LR0754BT1438 [0,1,0,0,0,0|3,0,0]=4 281 B12R2.10 Clc1sccc1C2=CCOC2 WXVL_LR0500BT1456 [0,1,0,0,0,0|3,0,0]=4 282 B12R2.10 Clc1sccc1c2cc[nH]c2 WXVL_LR0500BT5115 [0,1,0,0,0,0|2,1,0]=4 283 B12R2.10 Clc1sccc1c2cc[nH]n2 WXVL_LR0500BT0902 [0,1,0,0,0,0|3,0,0]=4 284 B12R2.10 Clc1sccc1c2ccoc2 WXVL_LR0500BT1598 [0,1,0,0,0,0|3,0,0]=4 285 B12R2.10 Clc1sccc1c2cn[nH]c2 WXVL_LR0500BT0829 [0,1,0,0,0,0|3,0,0]=4 286 B12R2.10 Clc1sccc1c2cncs2 WXVL_LR0500BT0771 [0,1,0,0,0,0|3,0,0]=4 287 B12R2.10 Clc1sccc1c2cnoc2 WXVL_LR0500BT1438 [0,1,0,0,0,0|2,0,0]=3 288 B12R2.10 Clc1sccc1c2cscn2 WXVL_LR0500BT0962 [0,1,0,0,0,0|3,0,0]=4 289 B12R2.10 Cn1cccc1c2ccon2 WXVL_LR0685BT4126 [0,1,0,0,0,0|3,0,0]=4 290 B12R2.10 Cn1cccc1c2cn[nH]n2 WXVL_LR0395BT4126 [0,1,0,0,0,0|3,0,0]=4 291 B12R2.10 Cn1cccc1c2cnoc2 WXVL_LR0706BT4126 [0,1,0,0,0,0|3,0,0]=4 292 B12R2.10 Cn1cncc1c2ccon2 WXVL_LR0685BT2181 [0,1,0,0,0,0|2,0,1]=4 293 B12R2.10 Cn1cncc1c2cn[nH]n2 WXVL_LR0395BT2181 [0,1,0,0,0,0|2,0,1]=4 294 B12R2.10 Cn1cncc1c2cnoc2 WXVL_LR0706BT2181 [0,1,0,0,0,0|2,0,1]=4 295 B12R2.10 Cn1cnnc1c2cc[nH]c2 WXVL_LR1200BT5115 [0,1,0,0,0,0|2,0,1]=4 296 B12R2.10 Cn1nccc1c2ccon2 WXVL_LR0685BT1718 [0,1,0,0,0,0|2,0,1]=4 297 B12R2.10 Cn1nccc1c2cn[nH]n2 WXVL_LR0395BT1718 [0,1,0,0,0,0|2,0,1]=4 298 B12R2.10 Cn1nccc1c2cnoc2 WXVL_LR0706BT1718 [0,1,0,0,0,0|2,0,1]=4 299 B12R2.10 Cn1ncnc1c2cc[nH]c2 WXVL_LR0640BT5115 [0,1,0,0,0,0|2,0,0]=3 300 B12R2.10 Cn1ncnc1c2cc[nH]n2 WXVL_LR0640BT0902 [0,1,0,0,0,0|3,0,0]=4 301 B12R2.10 Cn1ncnc1c2ccoc2 WXVL_LR0640BT1598 [0,1,0,0,0,0|3,0,0]=4 302 B12R2.10 Cn1ncnc1c2ccsc2 WXVL_LR0640BT1561 [0,1,0,0,0,0|3,0,0]=4 303 B12R2.10 Cn1ncnc1c2cn[nH]c2 WXVL_LR0640BT0829 [0,1,0,0,0,0|3,0,0]=4 304 B12R2.2 C1=C(CCNC1)c2ccon2 WXVL_LR0685BT1900 [0,0,0,0,0,1|1,0,2]=4 305 B12R2.2 C1=C(CCNC1)c2cn[nH]n2 WXVL_LR0395BT1900 [0,0,0,0,0,1|1,0,2]=4 306 B12R2.2 C1=C(CCNC1)c2cnoc2 WXVL_LR0706BT1900 [0,0,0,0,0,1|1,0,2]=4 307 B12R2.2 c1cc(ccn1)c2ccon2 WXVL_LR0685BT0574 [0,0,0,0,0,1|1,0,1]=3 308 B12R2.2 c1cc(ccn1)c2cn[nH]n2 WXVL_LR0395BT0574 [0,0,0,0,0,1|1,0,1]=3 309 B12R2.2 c1cc(ccn1)c2cnc[nH]2 WXVL_LR0418BT0574 [0,0,0,0,0,1|1,0,2]=4 310 B12R2.2 c1cc(ccn1)c2cnoc2 WXVL_LR0706BT0574 [0,0,0,0,0,1|1,0,1]=3 311 B12R2.2 c1cc(ccn1)c2cnsc2 WXVL_LR0652BT0574 [0,0,0,0,0,1|1,1,1]=4 312 B12R2.2 c1cc(ccn1)c2ncns2 WXVL_LR0623BT0574 [0,0,0,0,0,1|2,0,1]=4 313 B12R2.2 c1cc(cnn1)c2ccon2 WXVL_LR0685BT1744 [0,0,0,0,0,1|1,0,1]=3 314 B12R2.2 c1cc(cnn1)c2cn[nH]n2 WXVL_LR0395BT1744 [0,0,0,0,0,1|1,0,1]=3 315 B12R2.2 c1cc(cnn1)c2cnc[nH]2 WXVL_LR0418BT1744 [0,0,0,0,0,1|1,0,2]=4 316 B12R2.2 c1cc(cnn1)c2cnoc2 WXVL_LR0706BT1744 [0,0,0,0,0,1|1,0,1]=3 317 B12R2.2 c1cc(cnn1)c2cnsc2 WXVL_LR0652BT1744 [0,0,0,0,0,1|1,1,1]=4 318 B12R2.2 c1cc(cnn1)c2ncns2 WXVL_LR0623BT1744 [0,0,0,0,0,1|2,0,1]=4 319 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT0919 [0,0,0,0,0,1|2,0,0]=3 320 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT1115 [0,0,0,0,0,1|2,0,0]=3 321 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT2957 [0,0,0,0,0,1|2,0,0]=3 322 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0919 [0,0,0,0,0,1|2,0,0]=3 323 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT1115 [0,0,0,0,0,1|2,0,0]=3 324 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT2957 [0,0,0,0,0,1|2,0,0]=3 325 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT0919 [0,0,0,0,0,1|2,0,1]=4 326 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT1115 [0,0,0,0,0,1|2,0,1]=4 327 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT2957 [0,0,0,0,0,1|2,0,1]=4 328 B12R2.2 c1ccc(cc1)c2cnoc2 WXVL_LR0706BT0919 [0,0,0,0,0,1|2,0,0]=3 329 B12R2.2 c1ccc(cc1)c2cnoc2 WXVL_LR0706BT1115 [0,0,0,0,0,1|2,0,0]=3 330 B12R2.2 c1ccc(cc1)c2cnoc2 WXVL_LR0706BT2957 [0,0,0,0,0,1|2,0,0]=3 331 B12R2.2 c1ccc(cc1)c2cnsc2 WXVL_LR0652BT0919 [0,0,0,0,0,1|2,1,0]=4 332 B12R2.2 c1ccc(cc1)c2cnsc2 WXVL_LR0652BT1115 [0,0,0,0,0,1|2,1,0]=4 333 B12R2.2 c1ccc(cc1)c2cnsc2 WXVL_LR0652BT2957 [0,0,0,0,0,1|2,1,0]=4 334 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT0919 [0,0,0,0,0,1|3,0,0]=4 335 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT1115 [0,0,0,0,0,1|3,0,0]=4 336 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT2957 [0,0,0,0,0,1|3,0,0]=4 337 B12R2.2 c1ccc(nc1)c2ccon2 WXVL_LR0685BT0164 [0,0,0,0,0,1|2,0,0]=3 338 B12R2.2 c1ccc(nc1)c2cn[nH]n2 WXVL_LR0395BT0164 [0,0,0,0,0,1|2,0,0]=3 339 B12R2.2 c1ccc(nc1)c2cnc[nH]2 WXVL_LR0418BT0164 [0,0,0,0,0,1|2,0,1]=4 340 B12R2.2 c1ccc(nc1)c2cnoc2 WXVL_LR0706BT0164 [0,0,0,0,0,1|2,0,0]=3 341 B12R2.2 c1ccc(nc1)c2cnsc2 WXVL_LR0652BT0164 [0,0,0,0,0,1|2,1,0]=4 342 B12R2.2 c1ccc(nc1)c2ncns2 WXVL_LR0623BT0164 [0,0,0,0,0,1|3,0,0]=4 343 B12R2.2 c1cncc(c1)c2ccon2 WXVL_LR0685BT1208 [0,0,0,0,0,1|1,0,1]=3 344 B12R2.2 c1cncc(c1)c2ccon2 WXVL_LR0685BT3912 [0,0,0,0,0,1|1,0,1]=3 345 B12R2.2 c1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT1208 [0,0,0,0,0,1|1,0,1]=3 346 B12R2.2 c1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT3912 [0,0,0,0,0,1|1,0,1]=3 347 B12R2.2 c1cncc(c1)c2cnc[nH]2 WXVL_LR0418BT1208 [0,0,0,0,0,1|1,0,2]=4 348 B12R2.2 c1cncc(c1)c2cnc[nH]2 WXVL_LR0418BT3912 [0,0,0,0,0,1|1,0,2]=4 349 B12R2.2 c1cncc(c1)c2cnoc2 WXVL_LR0706BT1208 [0,0,0,0,0,1|1,0,1]=3 350 B12R2.2 c1cncc(c1)c2cnoc2 WXVL_LR0706BT3912 [0,0,0,0,0,1|1,0,1]=3 351 B12R2.2 c1cncc(c1)c2cnsc2 WXVL_LR0652BT1208 [0,0,0,0,0,1|1,1,1]=4 352 B12R2.2 c1cncc(c1)c2cnsc2 WXVL_LR0652BT3912 [0,0,0,0,0,1|1,1,1]=4 353 B12R2.2 c1cncc(c1)c2ncns2 WXVL_LR0623BT1208 [0,0,0,0,0,1|2,0,1]=4 354 B12R2.2 c1cncc(c1)c2ncns2 WXVL_LR0623BT3912 [0,0,0,0,0,1|2,0,1]=4 355 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [1,0,1,0,0,0|1,0,1]=4 356 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [1,0,1,0,0,0|1,0,1]=4 357 B13R2.12 Cc1ccc(cc1)c2ccon2 WXVL_LR0685BT1573 [0,1,0,0,0,1|2,0,0]=4 358 B13R2.12 Cc1ccc(cc1)c2ccon2 WXVL_LR0685BT3934 [0,1,0,0,0,1|2,0,0]=4 359 B13R2.12 Cc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT1573 [0,1,0,0,0,1|2,0,0]=4 360 B13R2.12 Cc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT3934 [0,1,0,0,0,1|2,0,0]=4 361 B13R2.12 Cc1ccc(cc1)c2cnoc2 WXVL_LR0706BT1573 [0,1,0,0,0,1|2,0,0]=4 362 B13R2.12 Cc1ccc(cc1)c2cnoc2 WXVL_LR0706BT3934 [0,1,0,0,0,1|2,0,0]=4 363 B13R2.12 Cc1ccc(cn1)c2ccon2 WXVL_LR0685BT0751 [0,1,0,0,0,1|1,0,1]=4 364 B13R2.12 Cc1ccc(cn1)c2ccon2 WXVL_LR0685BT2089 [0,1,0,0,0,1|1,0,1]=4 365 B13R2.12 Cc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT0751 [0,1,0,0,0,1|1,0,1]=4 366 B13R2.12 Cc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT2089 [0,1,0,0,0,1|1,0,1]=4 367 B13R2.12 Cc1ccc(cn1)c2cnoc2 WXVL_LR0706BT0751 [0,1,0,0,0,1|1,0,1]=4 368 B13R2.12 Cc1ccc(cn1)c2cnoc2 WXVL_LR0706BT2089 [0,1,0,0,0,1|1,0,1]=4 369 B13R2.12 Cc1ncc(cn1)c2ccon2 WXVL_LR0685BT1135 [0,1,0,0,0,1|1,0,1]=4 370 B13R2.12 Cc1ncc(cn1)c2ccon2 WXVL_LR0685BT2290 [0,1,0,0,0,1|1,0,1]=4 371 B13R2.12 Cc1ncc(cn1)c2cn[nH]n2 WXVL_LR0395BT1135 [0,1,0,0,0,1|1,0,1]=4 372 B13R2.12 Cc1ncc(cn1)c2cn[nH]n2 WXVL_LR0395BT2290 [0,1,0,0,0,1|1,0,1]=4 373 B13R2.12 Cc1ncc(cn1)c2cnoc2 WXVL_LR0706BT1135 [0,1,0,0,0,1|1,0,1]=4 374 B13R2.12 Cc1ncc(cn1)c2cnoc2 WXVL_LR0706BT2290 [0,1,0,0,0,1|1,0,1]=4 375 B13R2.12 Fc1ccc(cc1)c2ccon2 WXVL_LR0685BT0486 [0,1,0,0,0,1|2,0,0]=4 376 B13R2.12 Fc1ccc(cc1)c2ccon2 WXVL_LR0685BT0698 [0,1,0,0,0,1|2,0,0]=4 377 B13R2.12 Fc1ccc(cc1)c2ccon2 WXVL_LR0685BT2075 [0,1,0,0,0,1|2,0,0]=4 378 B13R2.12 Fc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0486 [0,1,0,0,0,1|2,0,0]=4 379 B13R2.12 Fc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0698 [0,1,0,0,0,1|2,0,0]=4 380 B13R2.12 Fc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT2075 [0,1,0,0,0,1|2,0,0]=4 381 B13R2.12 Fc1ccc(cc1)c2cnoc2 WXVL_LR0706BT0486 [0,1,0,0,0,1|2,0,0]=4 382 B13R2.12 Fc1ccc(cc1)c2cnoc2 WXVL_LR0706BT0698 [0,1,0,0,0,1|2,0,0]=4 383 B13R2.12 Fc1ccc(cc1)c2cnoc2 WXVL_LR0706BT2075 [0,1,0,0,0,1|2,0,0]=4 384 B13R2.12 Fc1ccc(cn1)c2ccon2 WXVL_LR0685BT2539 [0,1,0,0,0,1|1,0,1]=4 385 B13R2.12 Fc1ccc(cn1)c2ccon2 WXVL_LR0685BT3542 [0,1,0,0,0,1|1,0,1]=4 386 B13R2.12 Fc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT2539 [0,1,0,0,0,1|1,0,1]=4 387 B13R2.12 Fc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT3542 [0,1,0,0,0,1|1,0,1]=4 388 B13R2.12 Fc1ccc(cn1)c2cnoc2 WXVL_LR0706BT2539 [0,1,0,0,0,1|1,0,1]=4 389 B13R2.12 Fc1ccc(cn1)c2cnoc2 WXVL_LR0706BT3542 [0,1,0,0,0,1|1,0,1]=4 390 B13R2.12 Fc1ccc(nc1)c2ccon2 WXVL_LR0685BT0922 [0,1,0,0,0,1|2,0,0]=4 391 B13R2.12 Fc1ccc(nc1)c2cn[nH]n2 WXVL_LR0395BT0922 [0,1,0,0,0,1|2,0,0]=4 392 B13R2.12 Fc1ccc(nc1)c2cnoc2 WXVL_LR0706BT0922 [0,1,0,0,0,1|2,0,0]=4 393 B13R2.12 Fc1ncc(cn1)c2ccon2 WXVL_LR0685BT5754 [0,1,0,0,0,1|1,0,1]=4 394 B13R2.12 Fc1ncc(cn1)c2cn[nH]n2 WXVL_LR0395BT5754 [0,1,0,0,0,1|1,0,1]=4 395 B13R2.12 Fc1ncc(cn1)c2cnoc2 WXVL_LR0706BT5754 [0,1,0,0,0,1|1,0,1]=4 396 B13R2.12 Ic1ccc(cc1)c2ccon2 WXVL_LR0685BT1574 [0,1,0,0,0,1|2,0,0]=4 397 B13R2.12 Ic1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT1574 [0,1,0,0,0,1|2,0,0]=4 398 B13R2.12 Ic1ccc(cc1)c2cnoc2 WXVL_LR0706BT1574 [0,1,0,0,0,1|2,0,0]=4 399 B13R2.12 N=c1ncc(c[nH]1)c2ccon2 WXVL_LR0685BT0809 [0,1,0,0,0,1|1,0,0]=3 400 B13R2.12 N=c1ncc(c[nH]1)c2cn[nH]n2 WXVL_LR0395BT0809 [0,1,0,0,0,1|1,0,0]=3 401 B13R2.12 N=c1ncc(c[nH]1)c2cnc[nH]2 WXVL_LR0418BT0809 [0,1,0,0,0,1|1,0,1]=4 402 B13R2.12 N=c1ncc(c[nH]1)c2cnoc2 WXVL_LR0706BT0809 [0,1,0,0,0,1|1,0,0]=3 403 B13R2.12 N=c1ncc(c[nH]1)c2cnsc2 WXVL_LR0652BT0809 [0,1,0,0,0,1|1,1,0]=4 404 B13R2.12 N=c1ncc(c[nH]1)c2ncns2 WXVL_LR0623BT0809 [0,1,0,0,0,1|2,0,0]=4 405 B13R2.12 Oc1ccc(cc1)c2ccon2 WXVL_LR0685BT0555 [0,1,0,0,0,1|2,0,0]=4 406 B13R2.12 Oc1ccc(cc1)c2ccon2 WXVL_LR0685BT0699 [0,1,0,0,0,1|2,0,0]=4 407 B13R2.12 Oc1ccc(cc1)c2ccon2 WXVL_LR0685BT2080 [0,1,0,0,0,1|2,0,0]=4 408 B13R2.12 Oc1ccc(cc1)c2ccon2 WXVL_LR0685BT4830 [0,1,0,0,0,1|2,0,0]=4 409 B13R2.12 Oc1ccc(cc1)c2ccon2 WXVL_LR0685BT7243 [0,1,0,0,0,1|2,0,0]=4 410 B13R2.12 Oc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0555 [0,1,0,0,0,1|2,0,0]=4 411 B13R2.12 Oc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0699 [0,1,0,0,0,1|2,0,0]=4 412 B13R2.12 Oc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT2080 [0,1,0,0,0,1|2,0,0]=4 413 B13R2.12 Oc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT4830 [0,1,0,0,0,1|2,0,0]=4 414 B13R2.12 Oc1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT7243 [0,1,0,0,0,1|2,0,0]=4 415 B13R2.12 Oc1ccc(cc1)c2cnoc2 WXVL_LR0706BT0555 [0,1,0,0,0,1|2,0,0]=4 416 B13R2.12 Oc1ccc(cc1)c2cnoc2 WXVL_LR0706BT0699 [0,1,0,0,0,1|2,0,0]=4 417 B13R2.12 Oc1ccc(cc1)c2cnoc2 WXVL_LR0706BT2080 [0,1,0,0,0,1|2,0,0]=4 418 B13R2.12 Oc1ccc(cc1)c2cnoc2 WXVL_LR0706BT4830 [0,1,0,0,0,1|2,0,0]=4 419 B13R2.12 Oc1ccc(cc1)c2cnoc2 WXVL_LR0706BT7243 [0,1,0,0,0,1|2,0,0]=4 420 B13R2.12 Oc1ccc(cn1)c2ccon2 WXVL_LR0685BT1025 [0,1,0,0,0,1|1,0,1]=4 421 B13R2.12 Oc1ccc(cn1)c2ccon2 WXVL_LR0685BT1602 [0,1,0,0,0,1|1,0,1]=4 422 B13R2.12 Oc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT1025 [0,1,0,0,0,1|1,0,1]=4 423 B13R2.12 Oc1ccc(cn1)c2cn[nH]n2 WXVL_LR0395BT1602 [0,1,0,0,0,1|1,0,1]=4 424 B13R2.12 Oc1ccc(cn1)c2cnoc2 WXVL_LR0706BT1025 [0,1,0,0,0,1|1,0,1]=4 425 B13R2.12 Oc1ccc(cn1)c2cnoc2 WXVL_LR0706BT1602 [0,1,0,0,0,1|1,0,1]=4 426 B13R2.13 Cc1cc(ccn1)c2ccon2 WXVL_LR0685BT1792 [0,1,0,0,0,1|1,0,1]=4 427 B13R2.13 Cc1cc(ccn1)c2cn[nH]n2 WXVL_LR0395BT1792 [0,1,0,0,0,1|1,0,1]=4 428 B13R2.13 Cc1cc(ccn1)c2cnoc2 WXVL_LR0706BT1792 [0,1,0,0,0,1|1,0,1]=4 429 B13R2.13 Cc1cc(cnn1)c2ccon2 WXVL_LR0685BT6432 [0,1,0,0,0,1|1,0,1]=4 430 B13R2.13 Cc1cc(cnn1)c2cn[nH]n2 WXVL_LR0395BT6432 [0,1,0,0,0,1|1,0,1]=4 431 B13R2.13 Cc1cc(cnn1)c2cnoc2 WXVL_LR0706BT6432 [0,1,0,0,0,1|1,0,1]=4 432 B13R2.13 Cc1cccc(c1)c2ccon2 WXVL_LR0685BT0798 [0,1,0,0,0,1|2,0,0]=4 433 B13R2.13 Cc1cccc(c1)c2ccon2 WXVL_LR0685BT9299 [0,1,0,0,0,1|2,0,0]=4 434 B13R2.13 Cc1cccc(c1)c2cn[nH]n2 WXVL_LR0395BT0798 [0,1,0,0,0,1|2,0,0]=4 435 B13R2.13 Cc1cccc(c1)c2cn[nH]n2 WXVL_LR0395BT9299 [0,1,0,0,0,1|2,0,0]=4 436 B13R2.13 Cc1cccc(c1)c2cnoc2 WXVL_LR0706BT0798 [0,1,0,0,0,1|2,0,0]=4 437 B13R2.13 Cc1cccc(c1)c2cnoc2 WXVL_LR0706BT9299 [0,1,0,0,0,1|2,0,0]=4 438 B13R2.13 Cc1cccc(n1)c2ccon2 WXVL_LR0685BT2168 [0,1,0,0,0,1|2,0,0]=4 439 B13R2.13 Cc1cccc(n1)c2cn[nH]n2 WXVL_LR0395BT2168 [0,1,0,0,0,1|2,0,0]=4 440 B13R2.13 Cc1cccc(n1)c2cnoc2 WXVL_LR0706BT2168 [0,1,0,0,0,1|2,0,0]=4 441 B13R2.13 Cc1cncc(c1)c2ccon2 WXVL_LR0685BT1800 [0,1,0,0,0,1|1,0,1]=4 442 B13R2.13 Cc1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT1800 [0,1,0,0,0,1|1,0,1]=4 443 B13R2.13 Cc1cncc(c1)c2cnoc2 WXVL_LR0706BT1800 [0,1,0,0,0,1|1,0,1]=4 444 B13R2.13 Fc1cc(ccn1)c2ccon2 WXVL_LR0685BT0769 [0,1,0,0,0,1|1,0,1]=4 445 B13R2.13 Fc1cc(ccn1)c2cn[nH]n2 WXVL_LR0395BT0769 [0,1,0,0,0,1|1,0,1]=4 446 B13R2.13 Fc1cc(ccn1)c2cnoc2 WXVL_LR0706BT0769 [0,1,0,0,0,1|1,0,1]=4 447 B13R2.13 Fc1cccc(c1)c2ccon2 WXVL_LR0685BT1585 [0,1,0,0,0,1|2,0,0]=4 448 B13R2.13 Fc1cccc(c1)c2cn[nH]n2 WXVL_LR0395BT1585 [0,1,0,0,0,1|2,0,0]=4 449 B13R2.13 Fc1cccc(c1)c2cnoc2 WXVL_LR0706BT1585 [0,1,0,0,0,1|2,0,0]=4 450 B13R2.13 Fc1cccc(n1)c2ccon2 WXVL_LR0685BT2106 [0,1,0,0,0,1|2,0,0]=4 451 B13R2.13 Fc1cccc(n1)c2ccon2 WXVL_LR0685BT4494 [0,1,0,0,0,1|2,0,0]=4 452 B13R2.13 Fc1cccc(n1)c2cn[nH]n2 WXVL_LR0395BT2106 [0,1,0,0,0,1|2,0,0]=4 453 B13R2.13 Fc1cccc(n1)c2cn[nH]n2 WXVL_LR0395BT4494 [0,1,0,0,0,1|2,0,0]=4 454 B13R2.13 Fc1cccc(n1)c2cnoc2 WXVL_LR0706BT2106 [0,1,0,0,0,1|2,0,0]=4 455 B13R2.13 Fc1cccc(n1)c2cnoc2 WXVL_LR0706BT4494 [0,1,0,0,0,1|2,0,0]=4 456 B13R2.13 Fc1cncc(c1)c2ccon2 WXVL_LR0685BT0826 [0,1,0,0,0,1|1,0,1]=4 457 B13R2.13 Fc1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT0826 [0,1,0,0,0,1|1,0,1]=4 458 B13R2.13 Fc1cncc(c1)c2cnoc2 WXVL_LR0706BT0826 [0,1,0,0,0,1|1,0,1]=4 459 B13R2.13 N=c1cc(cc[nH]1)c2ccon2 WXVL_LR0685BT1655 [0,1,0,0,0,1|1,0,0]=3 460 B13R2.13 N=c1cc(cc[nH]1)c2ccon2 WXVL_LR0685BT1688 [0,1,0,0,0,1|1,0,0]=3 461 B13R2.13 N=c1cc(cc[nH]1)c2cn[nH]n2 WXVL_LR0395BT1655 [0,1,0,0,0,1|1,0,0]=3 462 B13R2.13 N=c1cc(cc[nH]1)c2cn[nH]n2 WXVL_LR0395BT1688 [0,1,0,0,0,1|1,0,0]=3 463 B13R2.13 N=c1cc(cc[nH]1)c2cnc[nH]2 WXVL_LR0418BT1655 [0,1,0,0,0,1|1,0,1]=4 464 B13R2.13 N=c1cc(cc[nH]1)c2cnc[nH]2 WXVL_LR0418BT1688 [0,1,0,0,0,1|1,0,1]=4 465 B13R2.13 N=c1cc(cc[nH]1)c2cnoc2 WXVL_LR0706BT1655 [0,1,0,0,0,1|1,0,0]=3 466 B13R2.13 N=c1cc(cc[nH]1)c2cnoc2 WXVL_LR0706BT1688 [0,1,0,0,0,1|1,0,0]=3 467 B13R2.13 N=c1cc(cc[nH]1)c2cnsc2 WXVL_LR0652BT1655 [0,1,0,0,0,1|1,1,0]=4 468 B13R2.13 N=c1cc(cc[nH]1)c2cnsc2 WXVL_LR0652BT1688 [0,1,0,0,0,1|1,1,0]=4 469 B13R2.13 N=c1cc(cc[nH]1)c2ncns2 WXVL_LR0623BT1655 [0,1,0,0,0,1|2,0,0]=4 470 B13R2.13 N=c1cc(cc[nH]1)c2ncns2 WXVL_LR0623BT1688 [0,1,0,0,0,1|2,0,0]=4 471 B13R2.13 Oc1cc(ccn1)c2ccon2 WXVL_LR0685BT2310 [0,1,0,0,0,1|1,0,1]=4 472 B13R2.13 Oc1cc(ccn1)c2ccon2 WXVL_LR0685BT5136 [0,1,0,0,0,1|1,0,1]=4 473 B13R2.13 Oc1cc(ccn1)c2cn[nH]n2 WXVL_LR0395BT2310 [0,1,0,0,0,1|1,0,1]=4 474 B13R2.13 Oc1cc(ccn1)c2cn[nH]n2 WXVL_LR0395BT5136 [0,1,0,0,0,1|1,0,1]=4 475 B13R2.13 Oc1cc(ccn1)c2cnoc2 WXVL_LR0706BT2310 [0,1,0,0,0,1|1,0,1]=4 476 B13R2.13 Oc1cc(ccn1)c2cnoc2 WXVL_LR0706BT5136 [0,1,0,0,0,1|1,0,1]=4 477 B13R2.13 Oc1cccc(c1)c2ccon2 WXVL_LR0685BT2076 [0,1,0,0,0,1|2,0,0]=4 478 B13R2.13 Oc1cccc(c1)c2cn[nH]n2 WXVL_LR0395BT2076 [0,1,0,0,0,1|2,0,0]=4 479 B13R2.13 Oc1cccc(c1)c2cnoc2 WXVL_LR0706BT2076 [0,1,0,0,0,1|2,0,0]=4 480 B13R2.13 Oc1cccc(n1)c2ccon2 WXVL_LR0685BT2413 [0,1,0,0,0,1|2,0,0]=4 481 B13R2.13 Oc1cccc(n1)c2cn[nH]n2 WXVL_LR0395BT2413 [0,1,0,0,0,1|2,0,0]=4 482 B13R2.13 Oc1cccc(n1)c2cnoc2 WXVL_LR0706BT2413 [0,1,0,0,0,1|2,0,0]=4 483 B13R2.13 Oc1cncc(c1)c2ccon2 WXVL_LR0685BT1374 [0,1,0,0,0,1|1,0,1]=4 484 B13R2.13 Oc1cncc(c1)c2ccon2 WXVL_LR0685BT1749 [0,1,0,0,0,1|1,0,1]=4 485 B13R2.13 Oc1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT1374 [0,1,0,0,0,1|1,0,1]=4 486 B13R2.13 Oc1cncc(c1)c2cn[nH]n2 WXVL_LR0395BT1749 [0,1,0,0,0,1|1,0,1]=4 487 B13R2.13 Oc1cncc(c1)c2cnoc2 WXVL_LR0706BT1374 [0,1,0,0,0,1|1,0,1]=4 488 B13R2.13 Oc1cncc(c1)c2cnoc2 WXVL_LR0706BT1749 [0,1,0,0,0,1|1,0,1]=4 489 B13R2.15 Cc1oncc1c2ccccc2 WXVL_LR0715BT0919 [0,1,0,0,0,1|2,0,0]=4 490 B13R2.15 Cc1oncc1c2ccccc2 WXVL_LR0715BT1115 [0,1,0,0,0,1|2,0,0]=4 491 B13R2.15 Cc1oncc1c2ccccc2 WXVL_LR0715BT2957 [0,1,0,0,0,1|2,0,0]=4 492 B13R2.15 Cc1oncc1c2ccccn2 WXVL_LR0715BT0164 [0,1,0,0,0,1|2,0,0]=4 493 B13R2.15 Cc1oncc1c2cccnc2 WXVL_LR0715BT1208 [0,1,0,0,0,1|1,0,1]=4 494 B13R2.15 Cc1oncc1c2cccnc2 WXVL_LR0715BT3912 [0,1,0,0,0,1|1,0,1]=4 495 B13R2.15 Cc1oncc1c2ccncc2 WXVL_LR0715BT0574 [0,1,0,0,0,1|1,0,1]=4 496 B13R2.15 Cc1oncc1c2ccnnc2 WXVL_LR0715BT1744 [0,1,0,0,0,1|1,0,1]=4 497 B13R2.18 Cc1ccccc1c2ccon2 WXVL_LR0685BT1515 [0,1,0,0,0,1|2,0,0]=4 498 B13R2.18 Cc1ccccc1c2ccon2 WXVL_LR0685BT4142 [0,1,0,0,0,1|2,0,0]=4 499 B13R2.18 Cc1ccccc1c2ccon2 WXVL_LR0685BT9252 [0,1,0,0,0,1|2,0,0]=4 500 B13R2.18 Cc1ccccc1c2cn[nH]n2 WXVL_LR0395BT1515 [0,1,0,0,0,1|2,0,0]=4 501 B13R2.18 Cc1ccccc1c2cn[nH]n2 WXVL_LR0395BT4142 [0,1,0,0,0,1|2,0,0]=4 502 B13R2.18 Cc1ccccc1c2cn[nH]n2 WXVL_LR0395BT9252 [0,1,0,0,0,1|2,0,0]=4 503 B13R2.18 Cc1ccccc1c2cnoc2 WXVL_LR0706BT1515 [0,1,0,0,0,1|2,0,0]=4 504 B13R2.18 Cc1ccccc1c2cnoc2 WXVL_LR0706BT4142 [0,1,0,0,0,1|2,0,0]=4 505 B13R2.18 Cc1ccccc1c2cnoc2 WXVL_LR0706BT9252 [0,1,0,0,0,1|2,0,0]=4 506 B13R2.18 Cc1ccncc1c2ccon2 WXVL_LR0685BT2595 [0,1,0,0,0,1|1,0,1]=4 507 B13R2.18 Cc1ccncc1c2cn[nH]n2 WXVL_LR0395BT2595 [0,1,0,0,0,1|1,0,1]=4 508 B13R2.18 Cc1ccncc1c2cnoc2 WXVL_LR0706BT2595 [0,1,0,0,0,1|1,0,1]=4 509 B13R2.18 Cc1cnccc1c2ccon2 WXVL_LR0685BT9635 [0,1,0,0,0,1|1,0,1]=4 510 B13R2.18 Cc1cnccc1c2cn[nH]n2 WXVL_LR0395BT9635 [0,1,0,0,0,1|1,0,1]=4 511 B13R2.18 Cc1cnccc1c2cnoc2 WXVL_LR0706BT9635 [0,1,0,0,0,1|1,0,1]=4 512 B13R2.18 Cc1ncccc1c2ccon2 WXVL_LR0685BT1625 [0,1,0,0,0,1|1,0,1]=4 513 B13R2.18 Cc1ncccc1c2ccon2 WXVL_LR0685BT1871 [0,1,0,0,0,1|1,0,1]=4 514 B13R2.18 Cc1ncccc1c2cn[nH]n2 WXVL_LR0395BT1625 [0,1,0,0,0,1|1,0,1]=4 515 B13R2.18 Cc1ncccc1c2cn[nH]n2 WXVL_LR0395BT1871 [0,1,0,0,0,1|1,0,1]=4 516 B13R2.18 Cc1ncccc1c2cnoc2 WXVL_LR0706BT1625 [0,1,0,0,0,1|1,0,1]=4 517 B13R2.18 Cc1ncccc1c2cnoc2 WXVL_LR0706BT1871 [0,1,0,0,0,1|1,0,1]=4 518 B13R2.18 Fc1ccccc1c2ccon2 WXVL_LR0685BT1435 [0,1,0,0,0,1|2,0,0]=4 519 B13R2.18 Fc1ccccc1c2ccon2 WXVL_LR0685BT1901 [0,1,0,0,0,1|2,0,0]=4 520 B13R2.18 Fc1ccccc1c2cn[nH]n2 WXVL_LR0395BT1435 [0,1,0,0,0,1|2,0,0]=4 521 B13R2.18 Fc1ccccc1c2cn[nH]n2 WXVL_LR0395BT1901 [0,1,0,0,0,1|2,0,0]=4 522 B13R2.18 Fc1ccccc1c2cnoc2 WXVL_LR0706BT1435 [0,1,0,0,0,1|2,0,0]=4 523 B13R2.18 Fc1ccccc1c2cnoc2 WXVL_LR0706BT1901 [0,1,0,0,0,1|2,0,0]=4 524 B13R2.18 Fc1cnccc1c2ccon2 WXVL_LR0685BT0661 [0,1,0,0,0,1|1,0,1]=4 525 B13R2.18 Fc1cnccc1c2cn[nH]n2 WXVL_LR0395BT0661 [0,1,0,0,0,1|1,0,1]=4 526 B13R2.18 Fc1cnccc1c2cnoc2 WXVL_LR0706BT0661 [0,1,0,0,0,1|1,0,1]=4 527 B13R2.18 Fc1ncccc1c2ccon2 WXVL_LR0685BT0740 [0,1,0,0,0,1|1,0,1]=4 528 B13R2.18 Fc1ncccc1c2cn[nH]n2 WXVL_LR0395BT0740 [0,1,0,0,0,1|1,0,1]=4 529 B13R2.18 Fc1ncccc1c2cnoc2 WXVL_LR0706BT0740 [0,1,0,0,0,1|1,0,1]=4 530 B13R2.18 Oc1ccccc1c2ccon2 WXVL_LR0685BT1646 [0,1,0,0,0,1|2,0,0]=4 531 B13R2.18 Oc1ccccc1c2cn[nH]n2 WXVL_LR0395BT1646 [0,1,0,0,0,1|2,0,0]=4 532 B13R2.18 Oc1ccccc1c2cnoc2 WXVL_LR0706BT1646 [0,1,0,0,0,1|2,0,0]=4 533 B13R2.18 Oc1ncccc1c2ccon2 WXVL_LR0685BT1653 [0,1,0,0,0,1|1,0,1]=4 534 B13R2.18 Oc1ncccc1c2cn[nH]n2 WXVL_LR0395BT1653 [0,1,0,0,0,1|1,0,1]=4 535 B13R2.18 Oc1ncccc1c2cnoc2 WXVL_LR0706BT1653 [0,1,0,0,0,1|1,0,1]=4 536 B13R2.4 CCn1cc(cn1)c2ccon2 WXVL_LR0685BT0916 [0,2,0,0,0,0|2,0,0]=4 537 B13R2.4 CCn1cc(cn1)c2cn[nH]n2 WXVL_LR0395BT0916 [0,2,0,0,0,0|2,0,0]=4 538 B13R2.4 CCn1cc(cn1)c2cnoc2 WXVL_LR0706BT0916 [0,2,0,0,0,0|2,0,0]=4 539 B13R2.4 CCn1ccc(n1)c2ccon2 WXVL_LR0685BT9709 [0,2,0,0,0,0|2,0,0]=4 540 B13R2.4 CCn1ccc(n1)c2cn[nH]n2 WXVL_LR0395BT9709 [0,2,0,0,0,0|2,0,0]=4 541 B13R2.4 CCn1ccc(n1)c2cnoc2 WXVL_LR0706BT9709 [0,2,0,0,0,0|2,0,0]=4 542 B13R2.4 COc1nc(cs1)c2cc[nH]c2 WXVL_LR0559BT5115 [0,2,0,0,0,0|2,0,0]=4 543 B13R2.4 N#Cc1cc(cs1)c2cnoc2 WXVL_LR0503BT1438 [0,2,0,0,0,0|2,0,0]=4 544 B13R2.4 N#Cc1n[nH]c(n1)c2cc[nH]c2 WXVL_LR0461BT5115 [0,2,0,0,0,0|2,0,0]=4 545 B13R2.4 N#Cc1nc(cs1)c2cc[nH]c2 WXVL_LR1074BT5115 [0,2,0,0,0,0|2,0,0]=4 546 B13R2.4 O=Cc1cc(c[nH]1)C2=CCOC2 WXVL_QS1573BT1456 [0,2,0,0,0,0|2,0,0]=4 547 B13R2.4 O=Cc1cc(c[nH]1)c2cc[nH]n2 WXVL_QS1573BT0902 [0,2,0,0,0,0|2,0,0]=4 548 B13R2.4 O=Cc1cc(c[nH]1)c2ccoc2 WXVL_QS1573BT1598 [0,2,0,0,0,0|2,0,0]=4 549 B13R2.4 O=Cc1cc(c[nH]1)c2cn[nH]c2 WXVL_QS1573BT0829 [0,2,0,0,0,0|2,0,0]=4 550 B13R2.4 O=Cc1cc(c[nH]1)c2cncs2 WXVL_QS1573BT0771 [0,2,0,0,0,0|2,0,0]=4 551 B13R2.4 O=Cc1cc(c[nH]1)c2cnoc2 WXVL_QS1573BT1438 [0,2,0,0,0,0|1,0,0]=3 552 B13R2.4 O=Cc1cc(c[nH]1)c2cscn2 WXVL_QS1573BT0962 [0,2,0,0,0,0|2,0,0]=4 553 B13R2.4 O=Cc1cc(co1)c2cc[nH]c2 WXVL_QS1888BT5115 [0,2,0,0,0,0|2,0,0]=4 554 B13R2.4 O=Cc1cc(co1)c2cnoc2 WXVL_QS1888BT1438 [0,2,0,0,0,0|2,0,0]=4 555 B13R2.4 O=Cc1cc(cs1)c2cnoc2 WXVL_QS0099BT1438 [0,2,0,0,0,0|2,0,0]=4 556 B13R2.4 O=Cc1nc(cs1)c2cc[nH]c2 WXVL_QS0464BT5115 [0,2,0,0,0,0|2,0,0]=4 557 B13R2.4 OCc1cc(cs1)c2ccon2 WXVL_LR0685BT1116 [0,2,0,0,0,0|2,0,0]=4 558 B13R2.4 OCc1cc(cs1)c2ccon2 WXVL_LR0685BT1953 [0,2,0,0,0,0|2,0,0]=4 559 B13R2.4 OCc1cc(cs1)c2cn[nH]n2 WXVL_LR0395BT1116 [0,2,0,0,0,0|2,0,0]=4 560 B13R2.4 OCc1cc(cs1)c2cn[nH]n2 WXVL_LR0395BT1953 [0,2,0,0,0,0|2,0,0]=4 561 B13R2.4 OCc1cc(cs1)c2cnoc2 WXVL_LR0706BT1116 [0,2,0,0,0,0|2,0,0]=4 562 B13R2.4 OCc1cc(cs1)c2cnoc2 WXVL_LR0706BT1953 [0,2,0,0,0,0|2,0,0]=4 563 B13R2.11 Cc1nc(no1)c2ccn(c2)C WXVL_LR0423BT5755 [0,2,0,0,0,0|2,0,0]=4 564 B13R2.11 Cc1ncc(s1)c2ccn(c2)C WXVL_LR0558BT5755 [0,2,0,0,0,0|2,0,0]=4 565 B13R2.11 Cn1ccc(c1)c2cn(nn2)C WXVL_LR0761BT5755 [0,2,0,0,0,0|1,0,1]=4 566 B13R2.11 Cn1ccc(c1)c2cnc(s2)Cl WXVL_LR1248BT5755 [0,2,0,0,0,0|2,0,0]=4 567 B13R2.11 Cn1ccc(c1)c2cnn(c2)C WXVL_LR0394BT5755 [0,2,0,0,0,0|2,0,0]=4 568 B13R2.11 Cn1ccc(c1)c2nnn(n2)C WXVL_LR1548BT5755 [0,2,0,0,0,0|2,0,0]=4 569 B13R2.144 Cc1cc(cs1)c2cnoc2C WXVL_LR0715BT9786 [0,2,0,0,0,0|2,0,0]=4 570 B13R2.144 Cc1cc(n[nH]1)c2cnoc2C WXVL_LR0715BT1880 [0,2,0,0,0,0|2,0,0]=4 571 B13R2.144 Cc1ncsc1c2ccn(c2)C WXVL_LR0791BT5755 [0,2,0,0,0,0|2,0,0]=4 572 B13R2.144 Cc1nocc1c2cnn(c2)C WXVL_LR0394BT0436 [0,2,0,0,0,0|2,0,0]=4 573 B13R2.144 Cc1nocc1c2cnn(c2)C WXVL_LR0394BT2400 [0,2,0,0,0,0|2,0,0]=4 574 B13R2.144 Cc1nocc1c2csc(c2)Cl WXVL_LR0844BT0436 [0,2,0,0,0,0|2,0,0]=4 575 B13R2.144 Cc1nocc1c2csc(c2)Cl WXVL_LR0844BT2400 [0,2,0,0,0,0|2,0,0]=4 576 B13R2.144 Cc1oncc1c2ccn(c2)C WXVL_LR0715BT5755 [0,2,0,0,0,0|1,0,0]=3 577 B13R2.144 Cc1oncc1c2ccn(n2)C WXVL_LR0715BT1862 [0,2,0,0,0,0|2,0,0]=4 578 B13R2.144 Cc1oncc1c2cnn(c2)C WXVL_LR0394BT1925 [0,2,0,0,0,0|2,0,0]=4 579 B13R2.144 Cc1oncc1c2cnn(c2)C WXVL_LR0715BT0701 [0,2,0,0,0,0|2,0,0]=4 580 B13R2.144 Cc1oncc1c2cnn(c2)C WXVL_LR0715BT1710 [0,2,0,0,0,0|2,0,0]=4 581 B13R2.144 Cc1oncc1c2csc(c2)Cl WXVL_LR0844BT1925 [0,2,0,0,0,0|2,0,0]=4 582 B13R2.144 Cn1ccc(c1)c2ncnn2C WXVL_LR0640BT5755 [0,2,0,0,0,0|2,0,0]=4 583 B13R2.149 Cc1cc(nn1C)c2cc[nH]c2 WXVL_LR0439BT5115 [0,2,0,0,0,0|2,0,0]=4 584 B13R2.149 Cc1cc(nn1C)c2cnoc2 WXVL_LR0439BT1438 [0,2,0,0,0,0|2,0,0]=4 585 B13R2.149 Cc1nc(cn1C)c2cc[nH]c2 WXVL_LR0396BT5115 [0,2,0,0,0,0|1,0,1]=4 586 B13R2.149 Cc1nc(cn1C)c2cnoc2 WXVL_LR0396BT1438 [0,2,0,0,0,0|2,0,0]=4 587 B13R2.2348 Cc1c(cnn1C)c2cc[nH]c2 WXVL_LR0401BT5115 [0,2,0,0,0,0|2,0,0]=4 588 B13R2.2348 Cc1c(cnn1C)c2ccon2 WXVL_LR0685BT5721 [0,2,0,0,0,0|2,0,0]=4 589 B13R2.2348 Cc1c(cnn1C)c2cn[nH]n2 WXVL_LR0395BT5721 [0,2,0,0,0,0|2,0,0]=4 590 B13R2.2348 Cc1c(cnn1C)c2cnoc2 WXVL_LR0401BT1438 [0,2,0,0,0,0|2,0,0]=4 591 B13R2.2348 Cc1c(cnn1C)c2cnoc2 WXVL_LR0706BT5721 [0,2,0,0,0,0|2,0,0]=4 592 B13R2.4666 Cc1cc(c(s1)C)c2ccon2 WXVL_LR0685BT5440 [0,2,0,0,0,0|2,0,0]=4 593 B13R2.4666 Cc1cc(c(s1)C)c2cn[nH]n2 WXVL_LR0395BT5440 [0,2,0,0,0,0|2,0,0]=4 594 B13R2.4666 Cc1cc(c(s1)C)c2cnoc2 WXVL_LR0706BT5440 [0,2,0,0,0,0|2,0,0]=4 595 B13R2.4666 Cc1cc(c(s1)C)c2cnoc2 WXVL_LR1593BT1438 [0,2,0,0,0,0|2,0,0]=4 596 B13R2.4666 Cc1cn(nc1c2cc[nH]c2)C WXVL_LR0469BT5115 [0,2,0,0,0,0|2,0,0]=4 597 B13R2.4666 Cc1cn(nc1c2cnoc2)C WXVL_LR0469BT1438 [0,2,0,0,0,0|2,0,0]=4 598 B13R2.4666 Cc1nc(c(s1)C)c2cc[nH]c2 WXVL_LR1309BT5115 [0,2,0,0,0,0|2,0,0]=4 599 B13R2.4666 Cc1nc(c(s1)c2cc[nH]c2)C WXVL_LR0650BT5115 [0,2,0,0,0,0|2,0,0]=4 600 B13R2.4666 Cc1nn(cc1c2ccon2)C WXVL_LR0685BT6346 [0,2,0,0,0,0|2,0,0]=4 601 B13R2.4666 Cc1nn(cc1c2cn[nH]n2)C WXVL_LR0395BT6346 [0,2,0,0,0,0|2,0,0]=4 602 B13R2.4666 Cc1nn(cc1c2cnoc2)C WXVL_LR0706BT6346 [0,2,0,0,0,0|2,0,0]=4 603 B13R2.61 CSc1sccc1c2ccon2 WXVL_LR0685BT3000 [0,2,0,0,0,0|2,0,0]=4 604 B13R2.61 CSc1sccc1c2cn[nH]n2 WXVL_LR0395BT3000 [0,2,0,0,0,0|2,0,0]=4 605 B13R2.61 CSc1sccc1c2cnoc2 WXVL_LR0706BT3000 [0,2,0,0,0,0|2,0,0]=4 606 B13R2.61 N#Cc1c[nH]nc1c2cc[nH]c2 WXVL_LR0446BT5115 [0,2,0,0,0,0|2,0,0]=4 607 B13R2.61 N#Cc1c[nH]nc1c2cnoc2 WXVL_LR0446BT1438 [0,2,0,0,0,0|2,0,0]=4 608 B13R2.61 N#Cc1cscc1c2cnoc2 WXVL_LR0783BT1438 [0,2,0,0,0,0|2,0,0]=4 609 B13R2.61 N#Cc1sccc1c2ccon2 WXVL_LR0685BT5441 [0,2,0,0,0,0|2,0,0]=4 610 B13R2.61 N#Cc1sccc1c2cn[nH]n2 WXVL_LR0395BT5441 [0,2,0,0,0,0|2,0,0]=4 611 B13R2.61 N#Cc1sccc1c2cnoc2 WXVL_LR0706BT5441 [0,2,0,0,0,0|2,0,0]=4 612 B13R2.61 N#Cc1sccc1c2cnoc2 WXVL_LR0829BT1438 [0,2,0,0,0,0|2,0,0]=4 613 B13R2.61 O=Cc1cscc1c2cnoc2 WXVL_QS0787BT1438 [0,2,0,0,0,0|2,0,0]=4 614 B13R2.61 O=Cc1occc1c2cc[nH]c2 WXVL_QS1403BT5115 [0,2,0,0,0,0|2,0,0]=4 615 B13R2.61 O=Cc1occc1c2cnoc2 WXVL_QS1403BT1438 [0,2,0,0,0,0|2,0,0]=4 616 B13R2.61 O=Cc1sccc1c2cnoc2 WXVL_QS0779BT1438 [0,2,0,0,0,0|2,0,0]=4 617 B13R2.61 OCc1sccc1c2ccon2 WXVL_LR0685BT3773 [0,2,0,0,0,0|2,0,0]=4 618 B13R2.61 OCc1sccc1c2cn[nH]n2 WXVL_LR0395BT3773 [0,2,0,0,0,0|2,0,0]=4 619 B13R2.61 OCc1sccc1c2cnoc2 WXVL_LR0706BT3773 [0,2,0,0,0,0|2,0,0]=4 620 B13R2.181 Cc1cscc1c2cnoc2C WXVL_LR0489BT1925 [0,2,0,0,0,0|2,0,0]=4 621 B13R2.181 Cc1cscc1c2cnoc2C WXVL_LR0715BT0862 [0,2,0,0,0,0|2,0,0]=4 622 B13R2.181 Cc1cscc1c2cnoc2C WXVL_LR0715BT0877 [0,2,0,0,0,0|2,0,0]=4 623 B13R2.181 Cc1cscc1c2conc2C WXVL_LR0489BT0436 [0,2,0,0,0,0|2,0,0]=4 624 B13R2.181 Cc1cscc1c2conc2C WXVL_LR0489BT2400 [0,2,0,0,0,0|2,0,0]=4 625 B13R2.181 Cc1n[nH]cc1c2cnoc2C WXVL_LR0715BT2283 [0,2,0,0,0,0|2,0,0]=4 626 B13R2.181 Cc1nocc1c2ccsc2Cl WXVL_LR0500BT0436 [0,2,0,0,0,0|2,0,0]=4 627 B13R2.181 Cc1nocc1c2ccsc2Cl WXVL_LR0500BT2400 [0,2,0,0,0,0|2,0,0]=4 628 B13R2.181 Cc1oncc1c2ccsc2Cl WXVL_LR0500BT1925 [0,2,0,0,0,0|2,0,0]=4 629 B13R2.3042 Cc1noc(c1c2cc[nH]c2)C WXVL_LR0657BT5115 [0,2,0,0,0,0|1,0,0]=3 630 B13R2.3042 Cc1noc(c1c2cc[nH]n2)C WXVL_LR0657BT0902 [0,2,0,0,0,0|2,0,0]=4 631 B13R2.3042 Cc1noc(c1c2ccoc2)C WXVL_LR0657BT1598 [0,2,0,0,0,0|2,0,0]=4 632 B13R2.3042 Cc1noc(c1c2ccsc2)C WXVL_LR0657BT1561 [0,2,0,0,0,0|2,0,0]=4 633 B13R2.3042 Cc1noc(c1c2cn[nH]c2)C WXVL_LR0657BT0829 [0,2,0,0,0,0|2,0,0]=4 634 B13R2.64 c1cc(ncn1)Nc2cc[nH]n2 WXVL_AF2373LP3358 [0,0,0,0,0,2|2,0,0]=4 635 B13R2.64 c1cc(ncn1)Nc2cc[nH]n2 WXVL_AF2373LP3358 [0,0,0,0,0,2|2,0,0]=4 636 B13R2.64 c1cc(ncn1)Nc2ccon2 WXVL_AF0028LP3358 [0,0,0,0,0,2|1,0,1]=4 637 B13R2.64 c1cc(ncn1)Nc2ccon2 WXVL_AF0028LP3358 [0,0,0,0,0,2|1,0,1]=4 638 B13R2.64 c1cc(ncn1)Nc2ccsc2 WXVL_AF00105LP3358 [0,0,0,0,0,2|2,0,0]=4 639 B13R2.64 c1cc(ncn1)Nc2ccsc2 WXVL_AF00105LP3358 [0,0,0,0,0,2|2,0,0]=4 640 B13R2.64 c1cc(ncn1)Nc2cn[nH]c2 WXVL_AF0097LP3358 [0,0,0,0,0,2|2,0,0]=4 641 B13R2.64 c1cc(ncn1)Nc2cn[nH]c2 WXVL_AF0097LP3358 [0,0,0,0,0,2|2,0,0]=4 642 B13R2.64 c1cc(ncn1)Nc2cnoc2 WXVL_AF0677LP3358 [0,0,0,0,0,2|1,0,1]=4 643 B13R2.64 c1cc(ncn1)Nc2cnoc2 WXVL_AF0677LP3358 [0,0,0,0,0,2|1,0,1]=4 644 B8R1.7 NC(=O)c1cnon1 WXVL_AK0084SC0777 [2,0,1,0,0,0|1,0,0]=4 645 B8R1.7 NC(=O)c1cnon1 WXVL_AK0084SC0777 [2,0,1,0,0,0|1,0,0]=4 646 B14R2.30 Cc1nonc1Nc2ccncn2 WXVL_AF0585LP3358 [0,1,0,0,0,2|0,0,1]=4 647 B14R2.30 Cc1nonc1Nc2ccncn2 WXVL_AF0585LP3358 [0,1,0,0,0,2|0,0,1]=4 648 B14R2.793 O=C(Nc1cc[nH]n1)c2cnon2 WXVL_AF2373SC0777 [0,1,0,0,0,2|1,0,0]=4 649 B14R2.793 O=C(Nc1cc[nH]n1)c2cnon2 WXVL_AF2373SC0777 [0,1,0,0,0,2|1,0,0]=4 650 B14R2.793 O=C(Nc1ccon1)c2cc[nH]c2 WXVL_AF0028SC0013 [0,1,0,0,0,2|1,0,0]=4 651 B14R2.793 O=C(Nc1ccon1)c2cc[nH]c2 WXVL_AF0028SC0013 [0,1,0,0,0,2|1,0,0]=4 652 B14R2.793 O=C(Nc1ccsc1)c2cnon2 WXVL_AF00105SC0777 [0,1,0,0,0,2|1,0,0]=4 653 B14R2.793 O=C(Nc1ccsc1)c2cnon2 WXVL_AF00105SC0777 [0,1,0,0,0,2|1,0,0]=4 654 B14R2.793 O=C(Nc1cn[nH]c1)c2cnon2 WXVL_AF0097SC0777 [0,1,0,0,0,2|1,0,0]=4 655 B14R2.793 O=C(Nc1cn[nH]c1)c2cnon2 WXVL_AF0097SC0777 [0,1,0,0,0,2|1,0,0]=4 656 B14R2.793 O=C(Nc1cnoc1)c2cc[nH]c2 WXVL_AF0677SC0013 [0,1,0,0,0,2|1,0,0]=4 657 B14R2.793 O=C(Nc1cnoc1)c2cc[nH]c2 WXVL_AF0677SC0013 [0,1,0,0,0,2|1,0,0]=4 658 B14R2.1 CN=c1ccc(c[nH]1)c2ccon2 WXVL_LR0685BT1854 [0,2,0,0,0,1|1,0,0]=4 659 B14R2.1 CN=c1ccc(c[nH]1)c2cn[nH]n2 WXVL_LR0395BT1854 [0,2,0,0,0,1|1,0,0]=4 660 B14R2.1 CN=c1ccc(c[nH]1)c2cnoc2 WXVL_LR0706BT1854 [0,2,0,0,0,1|1,0,0]=4 661 B14R2.1 CN=c1ncc(c[nH]1)c2ccon2 WXVL_LR0685BT0533 [0,2,0,0,0,1|1,0,0]=4 662 B14R2.1 CN=c1ncc(c[nH]1)c2cn[nH]n2 WXVL_LR0395BT0533 [0,2,0,0,0,1|1,0,0]=4 663 B14R2.1 CN=c1ncc(c[nH]1)c2cnoc2 WXVL_LR0706BT0533 [0,2,0,0,0,1|1,0,0]=4 664 B14R2.70 Cc1cc(c[nH]c1=N)c2ccon2 WXVL_LR0685BT0216 [0,2,0,0,0,1|1,0,0]=4 665 B14R2.70 Cc1cc(c[nH]c1=N)c2cn[nH]n2 WXVL_LR0395BT0216 [0,2,0,0,0,1|1,0,0]=4 666 B14R2.70 Cc1cc(c[nH]c1=N)c2cnoc2 WXVL_LR0706BT0216 [0,2,0,0,0,1|1,0,0]=4 667 B14R2.70 Cn1ccc(cc1=O)c2ccon2 WXVL_LR0685BT1642 [0,2,0,0,0,1|1,0,0]=4 668 B14R2.70 Cn1ccc(cc1=O)c2cn[nH]n2 WXVL_LR0395BT1642 [0,2,0,0,0,1|1,0,0]=4 669 B14R2.70 Cn1ccc(cc1=O)c2cnoc2 WXVL_LR0706BT1642 [0,2,0,0,0,1|1,0,0]=4 670 B14R2.926 Cc1oncc1c2cnc(=N)[nH]c2 WXVL_LR0715BT0809 [0,2,0,0,0,1|1,0,0]=4 671 B14R2.10 CN=c1cc(cc[nH]1)c2ccon2 WXVL_LR0685BT0473 [0,2,0,0,0,1|1,0,0]=4 672 B14R2.10 CN=c1cc(cc[nH]1)c2cn[nH]n2 WXVL_LR0395BT0473 [0,2,0,0,0,1|1,0,0]=4 673 B14R2.10 CN=c1cc(cc[nH]1)c2cnoc2 WXVL_LR0706BT0473 [0,2,0,0,0,1|1,0,0]=4 674 B14R2.23 Cn1cccc(c1=O)c2ccon2 WXVL_LR0685BT5746 [0,2,0,0,0,1|1,0,0]=4 675 B14R2.23 Cn1cccc(c1=O)c2ccon2 WXVL_LR0685BT7660 [0,2,0,0,0,1|1,0,0]=4 676 B14R2.23 Cn1cccc(c1=O)c2cn[nH]n2 WXVL_LR0395BT5746 [0,2,0,0,0,1|1,0,0]=4 677 B14R2.23 Cn1cccc(c1=O)c2cn[nH]n2 WXVL_LR0395BT7660 [0,2,0,0,0,1|1,0,0]=4 678 B14R2.23 Cn1cccc(c1=O)c2cnoc2 WXVL_LR0706BT5746 [0,2,0,0,0,1|1,0,0]=4 679 B14R2.23 Cn1cccc(c1=O)c2cnoc2 WXVL_LR0706BT7660 [0,2,0,0,0,1|1,0,0]=4 680 B14R2.269 Cc1oncc1c2cc[nH]c(=N)c2 WXVL_LR0715BT1655 [0,2,0,0,0,1|1,0,0]=4 681 B14R2.269 Cc1oncc1c2cc[nH]c(=N)c2 WXVL_LR0715BT1688 [0,2,0,0,0,1|1,0,0]=4 682 B14R2.121 Cc1nocc1c2c[nH]c(c2)C=O WXVL_QS1573BT0436 [0,3,0,0,0,0|1,0,0]=4 683 B14R2.121 Cc1nocc1c2c[nH]c(c2)C=O WXVL_QS1573BT2400 [0,3,0,0,0,0|1,0,0]=4 684 B14R2.121 Cc1oncc1c2c[nH]c(c2)C=O WXVL_QS1573BT1925 [0,3,0,0,0,0|1,0,0]=4 685 B14R2.4392 Cc1noc(c1c2ccn(c2)C)C WXVL_LR0657BT5755 [0,3,0,0,0,0|1,0,0]=4