0 B10R1.18 CC(=O)NC1=CC=CC=C1 AS-13389 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 AS-11744 [0,1,0,0,0,0|1,0,1]=3 2 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 PS-4663 [0,1,0,0,0,0|0,0,0]=1 3 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 AS-11992 [0,1,0,0,0,0|0,0,1]=2 4 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 KS-1423 [0,1,0,0,0,0|0,0,0]=1 5 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 STR08136 [0,1,0,0,0,0|0,0,0]=1 6 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 FS-2587 [0,1,0,0,0,0|0,0,0]=1 7 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 AS-49321 [0,0,0,1,0,0|2,0,1]=4 8 B9R1.6 CC(=O)C1=NC=CN=C1 PS-5458 [0,0,0,0,1,0|3,0,0]=4 9 B9R1.6 N=C(N)C1=CC=CC=C1 BS-3865 [0,0,0,0,1,0|2,0,0]=3 10 B9R1.6 NC(=O)C1=CC=CC=C1 DS-17194 [0,0,0,0,1,0|1,0,0]=2 11 B9R1.6 NC(=O)C1=CC=CN=C1 AS-13845 [0,0,0,0,1,0|2,0,0]=3 12 B9R1.6 NC(=O)C1=NC=CC=C1 GS-6464 [0,0,0,0,1,0|2,0,0]=3 13 B9R1.6 NC(=O)C1=NC=CN=C1 TS-01626 [0,0,0,0,1,0|3,0,0]=4 14 B9R1.6 NC(=S)C1=CC=NC=C1 BS-11860 [0,0,0,0,1,0|2,1,0]=4 15 B9R1.6 O=C(O)C1=CC=CN=C1 PS-4255 [0,0,0,0,1,0|1,0,0]=2 16 B9R1.6 O=C(O)C1=NC=CC=C1 PS-4253 [0,0,0,0,1,0|1,0,0]=2 17 B11R1.91 CC(=O)CCC1=CC=CC=C1 AS-54099 [0,0,0,0,0,1|1,0,0]=2 18 B11R1.91 O=C(O)CCC1=CC=CC=C1 BS-3829 [0,0,0,0,0,1|0,0,0]=1 19 B10R1.1 OCCC1=CC=C(O)C=C1 KS-5274 [1,1,0,0,0,0|0,0,1]=3 20 B10R1.15 O=CC(=O)C1=CC=CC=C1 FS-4230 [1,1,0,0,0,0|0,0,1]=3 21 B10R1.17 OC\C=C\C1=CC=CC=C1 BS-14235 [1,1,0,0,0,0|0,0,1]=3 22 B10R1.13 NC1=CC=C(C(=O)O)C=C1 AS-12493 [0,1,0,0,1,0|0,0,0]=2 23 B10R1.13 O=C(O)C1=CC=C(O)C=C1 STR01287 [0,1,0,0,1,0|0,0,0]=2 24 B10R1.13 O=C(O)C1=NC=C(O)N=C1 TS-00040 [0,1,0,0,1,0|2,0,0]=4 25 B10R1.13 O=C1C=CC(C(=O)O)=CN1 BS-3788 [0,1,0,0,1,0|1,0,0]=3 26 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 4C-038 [0,1,0,0,1,0|1,0,1]=4 27 B10R1.61 CC(=O)C1=C(O)C=CC=C1 PS-3396 [0,1,0,0,1,0|1,0,0]=3 28 B10R1.61 CC1=C(C(=O)O)C=CC=C1 AS-10809 [0,1,0,0,1,0|0,0,0]=2 29 B10R1.61 O=C(O)C1=C(O)C=CC=C1 TS-03583 [0,1,0,0,1,0|0,0,0]=2 30 B10R1.61 O=C(O)C1=C(O)C=CC=N1 PS-3718 [0,1,0,0,1,0|1,0,0]=3 31 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 AS-58723 [0,1,0,0,1,0|1,0,0]=3 32 B10R1.113 NC(=O)C1=CC(N)=CC=C1 AS-17352 [0,1,0,0,1,0|1,0,0]=3 33 B10R1.113 NC(=O)C1=CC=C[N+]([O-])=C1 AS-40816 [0,1,0,0,1,0|2,0,0]=4 34 B10R1.113 O=C(O)C1=CN(=O)=CC=C1 AS-57680 [0,1,0,0,1,0|1,0,0]=3 35 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 PS-4612 [0,1,0,0,0,1|1,0,0]=3 36 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 PS-5760 [0,1,0,0,0,1|0,0,0]=2 37 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 AS-12000 [0,1,0,0,0,1|0,0,1]=3 38 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 STR06515 [0,1,0,0,0,1|0,0,1]=3 39 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 DS-14380 [0,1,0,0,0,1|0,0,0]=2 40 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 DS-1833 [0,1,0,0,0,1|0,0,0]=2 41 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 PS-3381 [0,2,0,0,0,0|0,0,0]=2 42 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 BS-3887 [0,2,0,0,0,0|0,0,0]=2 43 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 PS-5820 [0,2,0,0,0,0|0,0,0]=2 44 B12R2.24 O=C1C=CC2=CC=CC=C2O1 CR-0048 [0,0,0,1,0,1|0,0,1]=3 45 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 VS-08570 [0,0,0,1,0,1|0,0,0]=2 46 B12R2.24 OC1=CC2=CC=CC=C2C=C1 HR-0304 [0,0,0,1,0,1|1,0,1]=4 47 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 HG-0202 [0,1,0,1,0,0|1,0,0]=3 48 B12R2.606 O=C1OC2=C(C=CC(O)=C2)S1 VS-08561 [0,1,0,1,0,0|1,0,0]=3 49 B8R1.7 O=C(O)C1=CC=CO1 PS-3380 [0,0,0,0,2,0|1,0,0]=3 50 B8R1.7 O=C(O)C1=COC=C1 PS-4247 [0,0,0,0,2,0|1,0,0]=3 51 B12R1.252 O=C(O)CCCC1=CC=CC=C1 PS-4322 [0,0,0,0,0,2|0,0,0]=2 52 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 AS-13914 [0,0,0,0,0,2|0,0,1]=3