0 B11R1.83 CCOc1ccc(cc1)[N+]#[C-] ISN-0531 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.83 COc1ccc(cc1)C[N+]#[C-] ISN-0033 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.1 [C-]#[N+]Cc1ccc(cc1)Cl ISN-0032 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.3 CCc1ccc(cc1)NN AHY-0050 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.3 CCc1ccc(cc1)[N+]#[C-] ISN-0078 [1,0,0,0,0,0|1,0,1]=3 5 B10R1.3 COc1ccc(cc1)NN AHY-0048 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.3 COc1ccc(cc1)[N+]#[C-] ISN-0053 [1,0,0,0,0,0|1,0,1]=3 7 B12R1.5 CCC(C)c1ccc(cc1)NN AHY-0074 [0,1,0,0,0,0|2,0,0]=3 8 B12R1.5 CSc1ccc(cc1)C(CO)N BAL-0018 [0,1,0,0,0,0|1,1,0]=3 9 B12R1.71 CCCCc1ccc(cc1)NN AHY-0038 [0,1,0,0,0,0|2,0,0]=3 10 B12R1.116 CCOc1ccc(cc1)C[N+]#[C-] ISN-0034 [0,1,0,0,0,0|1,0,1]=3 11 B12R2.44 COc1ccc2cc[nH]c2c1 MIX-0063 [0,0,0,1,0,0|1,0,2]=4 12 B9R1.8 [C-]#[N+]Cc1ccccc1 ISN-0155 [2,0,0,0,0,0|1,0,1]=4 13 B11R1.1 Cc1ccc(cc1)SCCN MIX-0962 [1,1,0,0,0,0|1,0,0]=3 14 B11R1.1 c1cc(ccc1SCCN)Cl MIX-0983 [1,1,0,0,0,0|2,0,0]=4 15 B11R1.22 Cc1ccc(cc1)C(CO)N BAL-0043 [1,1,0,0,0,0|1,0,0]=3 16 B11R1.22 c1cc(ccc1C(CO)N)Cl BAL-0031 [1,1,0,0,0,0|2,0,0]=4 17 B11R1.3 B(c1ccc(cc1)OC)(O)O MIX-0211 [1,1,0,0,0,0|2,0,0]=4 18 B11R1.3 CC(C)c1ccc(cc1)NN AHY-0204 [1,1,0,0,0,0|2,0,0]=4 19 B11R1.279 COc1ccc(cc1Cl)NN AHY-0089 [1,1,0,0,0,0|2,0,0]=4 20 B11R1.279 COc1ccc(cc1Cl)[N+]#[C-] ISN-0524 [1,1,0,0,0,0|1,0,1]=4 21 B13R1.35 Cc1cc(ccc1OC)CC(=O)O PAA-0103 [0,2,0,0,0,0|1,0,1]=4 22 B13R1.36 COc1ccc(cc1)C(C(=O)O)N AAA-0022 [0,2,0,0,0,0|1,0,1]=4 23 B13R1.142 CCOc1ccc(cc1)CC(=O)O PAA-0018 [0,2,0,0,0,0|1,0,1]=4 24 B13R1.585 CC(Cc1ccc(cc1)N(C)C)N MIX-0992 [0,2,0,0,0,0|1,0,0]=3 25 B13R1.653 COc1ccc(c(c1)Br)CC(=O)O PAA-0032 [0,2,0,0,0,0|1,0,1]=4 26 B13R1.139 CCOc1ccc(cc1)C(CO)N BAL-0013 [0,2,0,0,0,0|1,0,0]=3 27 B13R1.537 CC(C)c1ccc(cc1)C(CO)N BAL-0048 [0,2,0,0,0,0|2,0,0]=4 28 B13R1.3088 COc1ccc(cc1Cl)C(CO)N BAL-0053 [0,2,0,0,0,0|1,0,0]=3 29 B13R1.577 CCCCc1ccc(c(c1)Br)NN AHY-0108 [0,2,0,0,0,0|2,0,0]=4 30 B13R1.577 CCCCc1ccc(c(c1)I)NN AHY-0169 [0,2,0,0,0,0|2,0,0]=4