0 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M23388 [1,0,0,0,0,0|2,0,1]=4 1 B10R1.13 CC(=O)C1=CC=C(O)C=C1 M19367 [1,0,0,0,0,0|1,0,1]=3 2 B10R1.13 CC(C)C1=CC=C(O)C=C1 M19495 [1,0,0,0,0,0|0,0,0]=1 3 B10R1.13 CC1=CC=C(C(C)C)CC1 M21212 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.13 CC1=CCC(C(C)C)=CC1 M29208 [1,0,0,0,0,0|1,0,2]=4 5 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 M21502 [1,0,0,0,0,0|1,0,2]=4 6 B10R1.13 CN(C)c1ccc(N)cc1 M19730 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.13 Cc1ccc(C(C)C)cc1 M20194 [1,0,0,0,0,0|1,0,0]=2 8 B10R1.13 O=C(O)C1=CC=C(O)C=C1 M19308 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.13 O=[N+]([O-])c1ccc(O)cc1 M20047 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.1 C=Cc1ccc(O)cc1 M26541 [2,0,0,0,0,0|0,0,2]=4 11 B9R1.1 CCc1ccc(O)cc1 M20523 [2,0,0,0,0,0|0,0,0]=2 12 B9R1.1 COC1=CC=C(F)C=C1 M14546 [2,0,0,0,0,0|2,0,0]=4 13 B9R1.1 COC1=CC=C(O)C=C1 M12104 [2,0,0,0,0,0|1,0,0]=3 14 B9R1.1 NCc1ccc(O)cc1 M27368 [2,0,0,0,0,0|1,0,0]=3 15 B9R1.1 O=CC1=CC=C(O)C=C1 M17897 [2,0,0,0,0,0|1,0,1]=4 16 B9R1.1 OCC1=CC=C(O)C=C1 M18916 [2,0,0,0,0,0|1,0,0]=3 17 B9R1.1 OCc1ccc(O)cn1 M28306 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.6 CC(=O)c1ccccc1 M20888 [2,0,0,0,0,0|1,0,1]=4 19 B9R1.6 C[C@H](O)c1ccccc1 M19564 [2,0,0,0,0,0|1,0,0]=3 20 B11R1.3 CC(C)c1ccc(C=O)cc1 M20878 [1,1,0,0,0,0|0,0,1]=3 21 B11R1.3 CC(C)c1ccc(CO)cc1 M20877 [1,1,0,0,0,0|0,0,0]=2 22 B11R1.21 CC(=O)c1ccc(O)c(O)c1 M17870 [1,1,0,0,0,0|1,0,1]=4 23 B11R1.21 CC(C)C1=CC(O)=C(O)C=C1 M23971 [1,1,0,0,0,0|0,0,0]=2 24 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 M18658 [1,1,0,0,0,0|1,0,0]=3 25 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 M15712 [1,1,0,0,0,0|1,0,1]=4 26 B11R1.22 COC(=O)c1ccc(O)cc1 M19307 [1,1,0,0,0,0|1,0,1]=4 27 B11R1.22 NCC(O)C1=CC=C(O)C=C1 M15912 [1,1,0,0,0,0|1,0,0]=3 28 B11R1.22 O=C(CBr)c1ccc(O)cc1 M18306 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 M19368 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 M16461 [1,1,0,0,0,0|1,0,0]=3 31 B13R1.338 CC(=O)C1=CC=C(C(C)(C)C)C=C1 M16755 [0,2,0,0,0,0|0,0,1]=3 32 B11R1.561 CC1=CC=CC(C)(C)CC1=O M21282 [0,0,1,1,0,0|2,0,0]=4 33 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 M10198 [1,0,0,0,0,1|1,0,1]=4 34 B11R1.20 CC(=O)Oc1ccc(O)cc1 M22549 [1,0,0,0,0,1|1,0,1]=4 35 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 M22223 [1,0,0,0,0,1|1,0,0]=3 36 B11R1.509 [*][N+](C)(C)CC1=CC=CC=C1 M15995 [1,0,0,0,0,1|2,0,0]=4 37 B13R1.512 C[N+](C)(C)CCC1=CC=C(O)C=C1 M29452 [0,0,0,0,0,2|1,0,0]=3