0 B10R1.11 CCCC(=O)c1cccs1 T20377 [1,0,0,0,0,0|0,1,1]=3 1 B10R1.66 CC(=O)OCc1ccco1 T8088 [1,0,0,0,0,0|1,0,1]=3 2 B10R1.66 OC(=O)CCc1ccc[nH]1 T21185 [1,0,0,0,0,0|2,0,1]=4 3 B12R1.144 CC(C)=CC(=O)c1occc1C TN5853 [0,1,0,0,0,0|1,0,1]=3 4 B12R1.107 CC(=O)CC(=O)c1ccccc1 T20345 [0,0,0,0,0,1|1,0,0]=2 5 B12R1.107 CC(C)CC(=O)c1ccccc1 T20363 [0,0,0,0,0,1|2,0,1]=4 6 B12R1.107 CS(=O)CC(=O)c1ccccn1 T33841 [0,0,0,0,0,1|2,0,0]=3 7 B9R1.11 COC(=O)c1ccco1 T8022 [2,0,0,0,0,0|1,0,0]=3 8 B11R1.157 CC(=O)Nc1cccc(O)c1 T0914 [0,0,1,1,0,0|2,0,0]=4 9 B11R1.157 CC(=O)Oc1cccc(O)c1 T0339 [0,0,1,1,0,0|2,0,0]=4 10 B11R1.157 OC(=O)Cc1cccc(O)c1 T4829 [0,0,1,1,0,0|2,0,0]=4 11 B11R1.86 OC(=O)Cc1ccccc1O T5308 [0,0,1,1,0,0|2,0,0]=4 12 B11R1.16 CCCC(=O)c1ccccc1 T20324 [1,0,0,0,0,1|1,0,1]=4 13 B11R1.91 CC(=O)/C=C/c1ccccc1 TCS1554 [1,0,0,0,0,1|1,0,1]=4 14 B11R1.91 CC(=O)C=Cc1ccccc1 TN6993 [1,0,0,0,0,1|1,0,1]=4 15 B11R1.91 CC(=O)CCc1ccccc1 TCS1709 [1,0,0,0,0,1|1,0,1]=4 16 B11R1.91 CC(=O)COc1ccccc1 T25944 [1,0,0,0,0,1|2,0,0]=4 17 B11R1.36 CC(=O)C(=O)c1ccccc1 T7450 [0,0,0,0,1,1|1,0,0]=3 18 B11R1.36 OC(=O)C(=O)c1ccccc1 T8025 [0,0,0,0,1,1|2,0,0]=4 19 B13R1.45 OC(=O)CNC(=O)c1ccccc1 T4815 [0,0,0,0,0,2|2,0,0]=4 20 B13R1.45 OC(=O)CNC(=O)c1ccccc1 T8365 [0,0,0,0,0,2|2,0,0]=4 21 B13R1.45 OC(=O)CNC(=O)c1cccnc1 T5228 [0,0,0,0,0,2|2,0,0]=4