0 B10R1.61 CC1=CC=CN=C1[C@@H](C)O CS-0266895 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.6 C=C(F)C1=CC=CC=C1 CS-0454967 [1,0,0,0,0,0|1,0,1]=3 2 B9R1.6 C[C@H](N)C1=CC=CC=C1 CS-0434925 [1,0,0,0,0,0|1,0,1]=3 3 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0902642 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.156 CC1=C([C@@H](C)N)C(Cl)=CC=C1 CS-1184533 [0,1,0,0,0,0|2,0,1]=4 5 B11R1.156 CC1=C([N+](=O)[O-])C(N)=NC=C1 CS-D1521 [0,1,0,0,0,0|3,0,0]=4 6 B11R1.159 CC1=C(Cl)C=CN=C1C(=O)O CS-0210567 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CN=C1 CS-W005654 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.159 C[C@H](N)C1=C(Cl)C(F)=CC=C1 CS-1195758 [0,1,0,0,0,0|2,0,1]=4 9 B11R1.159 O=C(O)C1=NC=CC(F)=C1O CS-0634586 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.159 O=C(O)C1=NC=CC(I)=C1F CS-0343543 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.166 CC(=O)C1=C(Cl)N=C(C)C=C1 CS-0666087 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.166 CC1=C([C@H](C)N)C=CC(Br)=C1 CS-0890205 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=N1 CS-0733898 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.167 CN1C=CC(=O)C(C(N)=O)=C1 CS-0062330 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.167 O=C([O-])C1=C(F)C=CC(Cl)=C1 CS-0445802 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 CS-1195430 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.497 CC(C)C1=CC(=O)C=CC=C1 CS-0033908 [0,0,0,0,0,1|2,0,1]=4 18 B8R1.2 O=CC1=CC=NN=C1 CS-W023111 [2,0,0,0,0,0|2,0,0]=4 19 B8R1.5 OC1=C(S)C=CC=C1 CS-0010969 [2,0,0,0,0,0|1,0,1]=4 20 B10R1.28 CS(=N)(=O)C1=CC=CN=C1 CS-0628376 [1,1,0,0,0,0|2,0,0]=4 21 B10R1.113 C[C@H](N)C1=CC(I)=CC=C1 CS-1198131 [1,1,0,0,0,0|1,0,1]=4 22 B10R1.113 NC(=O)C1=CC(F)=NC=C1 CS-0375697 [1,1,0,0,0,0|2,0,0]=4 23 B10R1.2 CC1=C(Cl)C=CN=C1C=O CS-0668257 [1,1,0,0,0,0|2,0,0]=4 24 B10R1.25 CC1=CC(C)=C(C=O)N=C1 CS-0195749 [1,1,0,0,0,0|2,0,0]=4 25 B10R1.25 NC1=CC(I)=CC=C1C=O CS-0568411 [1,1,0,0,0,0|0,0,0]=2 26 B10R1.25 NC1=NC(F)=CC=C1C=O CS-0895662 [1,1,0,0,0,0|1,0,0]=3 27 B10R1.245 CCC1=C(C)C=CC=C1C CS-0643997 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.245 N#CC1=C(I)C=CC=C1N CS-0375899 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.245 NCC1=C(Cl)C=CC=C1N CS-0284164 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.75 O=CC1=CC=CC=C1CC(=O)O CS-M2515 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.127 NC(=O)NC1=CC(Cl)=CC=C1Cl CS-0911540 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.87 CNC1=C(F)C=CC=C1C(N)=O CS-0232126 [0,2,0,0,0,0|1,0,0]=3 33 B12R1.87 COC1=C(N)C=CC=C1C(C)=O CS-0567132 [0,2,0,0,0,0|1,0,0]=3 34 B12R1.437 CCC1=CC=CC(C)=C1C(=O)O CS-0449958 [0,2,0,0,0,0|2,0,0]=4 35 B12R1.440 CC(=O)C1=C(C)C(C#N)=CC=C1 CS-0615118 [0,2,0,0,0,0|1,0,0]=3 36 B12R1.440 NC(=O)C1=CC=CC(C=O)=C1F CS-0897380 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.511 CC1=CC(C(=O)O)=C(C)C(O)=C1 CS-0450377 [0,2,0,0,0,0|2,0,0]=4 38 B12R1.893 C=C(C)C1=CC=C(O)C(F)=C1F CS-0202176 [0,2,0,0,0,0|2,0,0]=4 39 B12R1.893 CC1=C(O)C(O)=CC=C1C(=O)O CS-M3469 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.893 NC1=CC=C(C(=O)O)C(Cl)=C1F CS-0441223 [0,2,0,0,0,0|2,0,0]=4 41 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=N1 CS-0455164 [0,2,0,0,0,0|2,0,0]=4 42 B12R1.354 COC(=O)C1=C(C)C=CC(=O)N1 CS-0752864 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.354 COC(=O)C1=C(N)N=NC(Cl)=C1 CS-0754285 [0,2,0,0,0,0|2,0,0]=4 44 B12R1.354 COC(=O)C1=NC(F)=CC=C1O CS-0564875 [0,2,0,0,0,0|2,0,0]=4 45 B12R2.202 O=C1CC2=C(N1)C(O)=CC=C2 CS-0569647 [0,0,0,1,0,1|1,0,0]=3 46 B12R2.203 CC1=CC=CC2=C1C(Br)=NN2 CS-0376330 [0,1,0,1,0,0|2,0,0]=4 47 B12R2.612 NC1=CNC2=C1C=CC(Cl)=C2 CS-1012613 [0,1,0,1,0,0|1,0,1]=4 48 B12R2.1 CCC1=C2C=CC=CC2=NN1 CS-0665570 [0,1,0,1,0,0|1,0,1]=4 49 B12R2.18 CC1=C(I)C2=CC=CC=C2N1 CS-0556954 [0,1,0,1,0,0|1,0,0]=3 50 B12R2.18 CN1C(=O)NC2=NC=CC=C21 CS-0086354 [0,1,0,1,0,0|2,0,0]=4 51 B12R2.18 O=C1NC2=C(C=CN=C2)C1=O CS-0147119 [0,1,0,1,0,0|1,0,1]=4 52 B8R1.7 CC(=O)C1=NSC=C1 CS-0567763 [1,0,0,0,1,0|2,0,0]=4 53 B12R1.125 NC1=C(\C=C\C(=O)O)C=CC=N1 CS-0560426 [0,0,0,0,0,2|2,0,0]=4