0 B12R1.6 CC(C)(O)C1=CC=C(CN)C=C1 CS-0375514 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.6 CP(C)(=O)C1=CC=C(CN)C=C1 CS-0528999 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.6 CS(=O)(=O)C1=NC=C(CN)C=C1 CS-0564444 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 CS-4481 [0,0,0,0,0,0|0,0,0]=0 4 B11R1.3 CCC1=CC=C(C(C)N)C=C1 CS-0446774 [1,0,0,0,0,0|3,0,0]=4 5 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 CS-W010819 [1,0,0,0,0,0|2,1,0]=4 6 B11R1.3 CNC1=CC=C(C(N)=O)C=C1 CS-0927405 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.3 O=[N+]([O-])C1=CC=C(CF)C=C1 CS-0510931 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.19 CC1=CC=C(P(C)(C)=O)C=C1 CS-0642953 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0210 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0255 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.19 CC1=NC=C(S(=O)(=O)Cl)C=C1 CS-0187232 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 CS-0128690 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.19 CS(=N)(=O)C1=CC=C(F)C=C1 CS-0047355 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.19 CS(=N)(=O)C1=CC=C(I)C=C1 CS-0645734 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.19 CS(=N)(=O)C1=CC=C(O)C=C1 CS-0645638 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.19 O=S(=O)(Cl)C1=NC=C(F)C=C1 CS-0376239 [1,0,0,0,0,0|3,0,0]=4 17 B13R1.38 COC1=CC=C(S(=O)(=O)Cl)C=C1C CS-0070893 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.96 N#CC1=CC=C(S(=O)(=O)Cl)C(F)=C1 CS-0566424 [0,1,0,0,0,0|1,0,2]=4 19 B13R1.96 N#CC1=CC=C(S(N)(=O)=O)C(F)=C1 CS-0263009 [0,1,0,0,0,0|0,0,2]=3 20 B13R1.96 NCC1=CC=C(S(N)(=O)=O)C(F)=C1 CS-0887973 [0,1,0,0,0,0|0,0,0]=1 21 B13R1.338 CC(C)C1=CN=C(S(N)(=O)=O)C=C1 CS-0497179 [0,1,0,0,0,0|2,0,0]=3 22 B13R1.338 C[C@@H](N)C1=CC=C(S(N)(=O)=O)C=C1 CS-0697230 [0,1,0,0,0,0|0,0,0]=1 23 B13R1.338 NS(=O)(=O)C1=CC=C(C(=O)O)C=N1 CS-0565631 [0,1,0,0,0,0|2,0,1]=4 24 B13R1.4 C#CC1=CC=C(NS(C)(=O)=O)C=C1 CS-0259998 [0,0,0,0,0,1|2,0,1]=4 25 B10R1.3 CSC1=CC=C(CN)C=C1 CS-0206938 [2,0,0,0,0,0|1,0,1]=4 26 B10R1.13 CC(N)C1=CC=C(N)C=C1 CS-0274936 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.13 C[C@@H](N)C1=CC=C(N)C=C1 CS-0000288 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 CS-0000287 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.28 CS(=N)(=O)C1=CC=CC=C1 CS-0047091 [2,0,0,0,0,0|1,0,1]=4 30 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 CS-0441475 [1,1,0,0,0,0|2,0,0]=4 31 B12R1.48 CC1=CC(C(=O)O)=CC=C1CN CS-1174475 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.113 N#CCC1=CC=C(C(N)=O)C=C1 CS-0243103 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.9 C=CS(=O)(=O)C1=CC=C(N)C=C1 CS-0654777 [1,1,0,0,0,0|1,0,0]=3 34 B12R1.9 CC1=CC=C(S(=O)(=O)O[Ag])C=C1 CS-0085621 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.9 CC1=CC=C(S(=O)(=O)[N-]Cl)C=C1 CS-7121 [1,1,0,0,0,0|0,0,1]=3 36 B12R1.23 CS(=O)(=O)C1=CC(N)=C(O)C=C1 CS-W016855 [1,1,0,0,0,0|2,0,0]=4 37 B12R1.23 CS(=O)(=O)C1=CC=C(O)C(Br)=C1 CS-0435064 [1,1,0,0,0,0|2,0,0]=4 38 B12R1.23 NC1=CC=C(S(N)(=O)=O)C=C1F CS-0517577 [1,1,0,0,0,0|0,0,0]=2 39 B12R1.23 NS(=O)(=O)C1=CC=C(F)C(Br)=C1 CS-0350970 [1,1,0,0,0,0|1,0,0]=3 40 B12R1.23 O=S(=O)(F)C1=CC=C(Br)C(F)=C1 CS-0643273 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.126 NC1=CC(F)=CC=C1S(N)(=O)=O CS-0504306 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.351 CC1=CC=C(C)(S(=O)(=O)[O-])C=C1 CS-0504154 [1,1,0,0,0,0|1,0,1]=4 43 B14R1.4227 CN(C)C1=C(N)C=C(S(N)(=O)=O)C=C1 CS-0456220 [0,2,0,0,0,0|2,0,0]=4 44 B14R1.213 CC(C)S(=O)(=O)C1=CC=C(CN)C=C1 CS-0612235 [0,2,0,0,0,0|1,0,0]=3 45 B14R1.307 CNS(=O)(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-0140419 [0,2,0,0,0,0|2,0,0]=4 46 B14R2.3125 NS(=O)(=O)C1=CC2=C(C=C1)COC2 CS-0120223 [0,1,0,1,0,0|1,0,0]=3 47 B14R2.3125 NS(=O)(=O)C1=CC2=C(C=C1)NC=C2 CS-0054226 [0,1,0,1,0,0|1,0,1]=4 48 B12R1.106 CS(=O)(=O)NC1=CC=C(O)C=C1 CS-0116400 [1,0,0,0,0,1|2,0,0]=4 49 B12R1.436 CS(=O)(=O)C1=NC=CC(CN)=C1 CS-0781615 [0,0,0,0,1,1|1,0,0]=3