0 B10R1.3 CCc1ccc(cc1)NN AHY-0050 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.3 CCc1ccc(cc1)[N+]#[C-] ISN-0078 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.3 COc1ccc(cc1)NN AHY-0048 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.3 COc1ccc(cc1)[N+]#[C-] ISN-0053 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.3 c1cc(ccc1C#N)NN AHY-0084 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.1 [C-]#[N+]c1ccc(cc1)Br ISN-0517 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.1 [C-]#[N+]c1ccc(cc1)Cl ISN-0726 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.1 [C-]#[N+]c1ccc(cc1)F ISN-0523 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.1 c1cc(ccc1NN)I AHY-0045 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.3 B(c1ccc(cc1)OC)(O)O MIX-0211 [0,1,0,0,0,0|1,0,0]=2 10 B11R1.3 CC(C)c1ccc(cc1)NN AHY-0204 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.3 c1cc(ccc1C(=O)O)NN AHY-0131 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.83 CCOc1ccc(cc1)[N+]#[C-] ISN-0531 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.83 COc1ccc(cc1)C[N+]#[C-] ISN-0033 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.279 COc1ccc(cc1Cl)NN AHY-0089 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.279 COc1ccc(cc1Cl)[N+]#[C-] ISN-0524 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.1 [C-]#[N+]Cc1ccc(cc1)Cl ISN-0032 [1,1,0,0,0,0|2,0,0]=4 17 B10R1.13 c1cc(ncc1O)C(=O)O MIX-0152 [1,1,0,0,0,0|1,0,1]=4 18 B10R1.25 Cc1ccc(c(c1)Br)NN AHY-0034 [1,1,0,0,0,0|2,0,0]=4 19 B10R1.25 Cc1ccc(c(c1)C)NN AHY-0030 [1,1,0,0,0,0|2,0,0]=4 20 B10R1.176 Cc1ccc(cc1C)NN AHY-0031 [1,1,0,0,0,0|2,0,0]=4 21 B10R1.176 Cc1ccc(cc1C)[N+]#[C-] ISN-0085 [1,1,0,0,0,0|1,0,1]=4 22 B10R1.176 Cc1ccc(cc1Cl)NN AHY-0002 [1,1,0,0,0,0|2,0,0]=4 23 B10R1.176 Cc1ccc(cc1Cl)[N+]#[C-] ISN-0068 [1,1,0,0,0,0|1,0,1]=4 24 B12R1.5 CSc1ccc(cc1)C(CO)N BAL-0018 [0,2,0,0,0,0|0,1,0]=3 25 B12R1.116 CCOc1ccc(cc1)C[N+]#[C-] ISN-0034 [0,2,0,0,0,0|1,0,0]=3 26 B12R1.78 COc1ccc(c(c1)OC)[N+]#[C-] ISN-0729 [0,2,0,0,0,0|2,0,0]=4 27 B12R2.44 COc1ccc2cc[nH]c2c1 MIX-0063 [0,1,0,1,0,0|1,0,1]=4 28 B10R1.172 COc1cccc(c1)[N+]#[C-] ISN-0052 [0,0,0,0,1,1|2,0,0]=4