0 B12R1.6 C#CC1=CC=C(S(C)(=O)=O)C=C1 CS-0042601 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.6 CS(=O)(=O)C1=CC=C(CO)C=C1 CS-0046235 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.6 NCC1=CC=C(C(F)(F)F)C=C1 CS-W007523 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.6 NNC1=CC=C(S(N)(=O)=O)C=C1 CS-W019536 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CS-0030581 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.3 COC1=CC=C(C(N)=O)C=C1 CS-W022205 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.3 NCC1=CC=C(B(O)O)C=C1 CS-0042868 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CS-W018098 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 CS-W015931 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0038697 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-D0217 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-D1126 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-W005880 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-W006139 [1,0,0,0,0,0|1,0,0]=2 14 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-W022910 [1,0,0,0,0,0|1,0,0]=2 15 B11R1.19 CC1=CN=C(S(N)(=O)=O)C=C1 CS-W017596 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 CS-W006199 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 CS-W005110 [1,0,0,0,0,0|1,0,0]=2 18 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 CS-W022956 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=N1 CS-0030454 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 CS-W008954 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.19 O=S(=O)(Cl)C1=CC=C(Cl)N=C1 CS-W009066 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.19 O=S(=O)(Cl)C1=NC=C(Br)C=C1 CS-0043600 [1,0,0,0,0,0|3,0,0]=4 23 B13R1.96 COC1=CC=C(S(C)(=O)=O)C(I)=C1 CS-0041043 [0,1,0,0,0,0|3,0,0]=4 24 B13R1.338 CC(N)C1=CC=C(S(C)(=O)=O)C=C1 CS-D0009 [0,1,0,0,0,0|1,0,0]=2 25 B11R1.45 NCC1=CC=C(S(N)(=O)=O)S1 CS-B1565 [0,0,0,0,1,0|1,0,0]=2 26 B10R1.13 CC(=O)C1=CC=C(N)C=C1 CS-W009534 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 CS-W019426 [2,0,0,0,0,0|0,0,1]=3 28 B10R1.13 N=C(N)C1=CC=C(N)C=C1 CS-W019509 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS-W016478 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.113 NCCC1=CC=C([N+](=O)[O-])C=C1 CS-0011439 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 CS-M0681 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.452 O=N(=O)C1=C(F)C=C(CO)C=C1 CS-0043771 [1,1,0,0,0,0|2,0,0]=4 33 B12R1.9 CC1=CC=C(S(=O)(=O)NN)C=C1 CS-W004691 [1,1,0,0,0,0|0,0,0]=2 34 B12R1.23 CS(=O)(=O)C1=CC(F)=C(F)C=C1 CS-W015819 [1,1,0,0,0,0|2,0,0]=4 35 B12R1.23 CS(=O)(=O)C1=CC=C(N)C(F)=C1 CS-W003354 [1,1,0,0,0,0|1,0,0]=3 36 B12R1.126 NS(=O)(=O)C1=C(F)C=C(F)C=C1 CS-W010691 [1,1,0,0,0,0|1,0,0]=3 37 B12R1.126 O=S(=O)(Cl)C1=CC=C(Br)C=C1F CS-W022095 [1,1,0,0,0,0|2,0,0]=4 38 B14R2.3125 O=S(=O)(Cl)C1=CC=C2OCCC2=C1 CS-W013158 [0,1,0,1,0,0|2,0,0]=4