0 B10R1.13 CC(C)C1=CC=C(N)C=C1 DB02114 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.13 NC1=CC=C(C(=O)O)C=C1 DB02362 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 DB03728 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.13 O=C(O)C1=CC=C(O)C=C1 DB04242 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.13 O=C(O)C1=CC=C([Hg])C=C1 DB03975 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 DB04417 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.1 O=CC1=CC=C(O)C=C1 DB03560 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.1 OCC1=CC=C(Br)C=C1 DB02822 [1,0,0,0,0,0|1,0,2]=4 8 B9R1.1 [NH3+]CC1=CC=C(F)C=C1 DB03243 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.6 CC(=O)C1=CC=CC=C1 DB04619 [1,0,0,0,0,0|0,0,0]=1 10 B9R1.6 C[C@@H](O)C1=CC=CC=C1 DB04784 [1,0,0,0,0,0|0,0,2]=3 11 B9R1.6 NC(=[NH2+])C1=CC=CC=C1 DB03127 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.6 O=[S@](O)C1=CC=CC=C1 DB03848 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.6 OB(O)C1=CC=CC=C1 DB01795 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.3 COC1=CC=C(C(=O)O)C=C1 DB02795 [0,1,0,0,0,0|1,0,0]=2 15 B11R1.3 COC1=CC=C([SH](=O)=O)C=C1 DB03033 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.3 N=C(N)C1=CC=C(CO)C=C1 DB02585 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.3 O=C(O)C1=CC=C([Hg]O)C=C1 DB01671 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DB03120 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.19 NC1=CC=C([As](=O)(O)O)C=C1 DB03006 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.19 NS(=O)(=O)C1=CC=C(F)C=C1 DB01784 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.19 O=S(=O)(O)C1=CC=C([Hg])C=C1 DB02983 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 DB03946 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 DB03407 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 DB02839 [0,1,0,0,0,0|2,0,0]=3 25 B8R1.2 NCC1=CC=CC=C1 DB02464 [2,0,0,0,0,0|1,0,1]=4 26 B8R1.3 CC1=CC=C(O)C=C1 DB01688 [2,0,0,0,0,0|0,0,1]=3 27 B8R1.3 NC1=CC=C(N)C=C1 DB14141 [2,0,0,0,0,0|2,0,0]=4 28 B8R1.3 NC1=CC=C(O)C=C1 DB14144 [2,0,0,0,0,0|1,0,1]=4 29 B8R1.3 OC1=CC=C(I)C=C1 DB03002 [2,0,0,0,0,0|1,0,1]=4 30 B10R1.1 OCCC1=CC=C(F)C=C1 DB03669 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.15 O=C(NO)C1=CC=CC=C1 DB01924 [1,1,0,0,0,0|1,0,0]=3 32 B10R1.61 NC1=CC=CC=C1C(=O)O DB04166 [1,1,0,0,0,0|1,0,0]=3 33 B10R1.61 O=C(O)C1=C(S)C=CC=C1 DB14026 [1,1,0,0,0,0|1,0,0]=3 34 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 DB01854 [1,1,0,0,0,0|2,0,0]=4 35 B10R1.113 NC1=CC=CC(C(=O)O)=C1 DB02054 [1,1,0,0,0,0|1,0,0]=3 36 B12R1.4 COC1=CC=C(CC(C)N)C=C1 DB01472 [0,1,0,0,0,1|1,0,1]=4 37 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 DB08767 [0,1,0,0,0,1|1,0,0]=3 38 B12R1.4 N=C(N)NC1=CC=C(CO)C=C1 DB06900 [0,1,0,0,0,1|2,0,0]=4 39 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 DB01702 [0,1,0,0,0,1|2,0,0]=4 40 B12R1.20 NC(C(=O)O)C1=CC=C(O)C=C1 DB02601 [0,1,0,0,0,1|2,0,0]=4 41 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 DB04291 [0,1,0,0,0,1|2,0,0]=4 42 B12R1.20 [C@@H](O)(C(=O)O)C1=CC=C(O)C=C1 DB07896 [0,1,0,0,0,1|2,0,0]=4 43 B12R1.20 [C@H](N)(C(=O)O)C1=CC=C(O)C=C1 DB04308 [0,1,0,0,0,1|2,0,0]=4 44 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 DB08748 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 DB03140 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.56 COC1=CC(C(=O)[O-])=CC=C1O DB02130 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1O DB04598 [0,2,0,0,0,0|2,0,0]=4 48 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 DB04499 [1,0,0,1,0,0|0,0,2]=4 49 B8R1.7 O=C(O)C1=CC=CN1 DB02543 [1,0,0,0,1,0|2,0,0]=4 50 B10R1.18 NC(=S)NC1=CC=CC=C1 DB03694 [1,0,0,0,0,1|1,1,0]=4 51 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 DB03400 [0,0,0,0,0,2|1,0,0]=3 52 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 DB03210 [0,0,0,0,0,2|2,0,0]=4 53 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 DB03897 [0,0,0,0,0,2|2,0,0]=4 54 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 DB04066 [0,0,0,0,0,2|2,0,0]=4