0 B8R1.8 ON=CC1=CC=CN1 CS-0036536 [1,0,0,0,0,0|2,0,1]=4 1 B10R1.66 O=C(O)\C=C\C1=CC=CS1 CS-W018039 [0,1,0,0,0,0|0,1,0]=2 2 B10R2.7 C1=CC2=C(C=CO2)C=N1 CS-0084800 [0,0,0,1,0,0|2,0,0]=3 3 B10R2.7 C1=CC2=C(C=NC=N2)S1 CS-0088133 [0,0,0,1,0,0|2,1,0]=4 4 B10R1.17 O=CCSC1=CC=CC=C1 CS-0102366 [0,0,0,0,0,1|2,0,1]=4 5 B10R1.17 O=CNCC1=CC=CC=C1 CS-0009966 [0,0,0,0,0,1|2,0,1]=4 6 B7R1.1 O=CC1=COC=N1 CS-0044894 [2,0,0,0,0,0|2,0,0]=4 7 B9R1.13 CC(=O)CC1=CC=CS1 CS-0037233 [1,1,0,0,0,0|0,1,1]=4 8 B11R1.1 C(C=O)=CC1=CC=C(Br)C=C1 CS-W015068 [0,1,0,0,0,1|1,0,0]=3 9 B11R1.24 O=C\C=C\C1=CC=CC(Cl)=C1 CS-0091222 [0,1,0,0,0,1|1,0,0]=3 10 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 CS-0109600 [0,1,0,0,0,1|1,0,0]=3 11 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 CS-0106251 [0,2,0,0,0,0|0,0,2]=4 12 B11R1.77 O=C(O)CC(=O)C1=CC=CO1 CS-0088868 [0,2,0,0,0,0|0,0,1]=3 13 B11R1.75 CC1=CC=C(\C=C\C(=O)O)S1 CS-0062473 [0,2,0,0,0,0|0,1,0]=3 14 B11R1.25 COC(=O)\C=C\C1=CC=CS1 CS-0062383 [0,2,0,0,0,0|0,1,0]=3 15 B9R1.2 C=CC1=CC(C)=CC=C1 CS-0110437 [0,0,1,1,0,0|2,0,0]=4 16 B9R1.2 O=CC1=CC=CC(=O)N1 CS-0046233 [0,0,1,1,0,0|1,0,1]=4 17 B9R1.2 O=CC1=CN=CC(Cl)=C1 CS-0036365 [0,0,1,1,0,0|2,0,0]=4 18 B9R1.15 C=CC1=CC=CC=C1C CS-0110436 [0,0,1,1,0,0|2,0,0]=4 19 B9R1.69 CN1C=C(O)C=CC1=O CS-0050460 [0,0,1,1,0,0|1,0,1]=4 20 B9R1.69 NC1=CC(O)=CC=C1Br CS-B0717 [0,0,1,1,0,0|2,0,0]=4 21 B9R1.69 OC1=CC(Cl)=C(F)C=C1 CS-W007874 [0,0,1,1,0,0|2,0,0]=4 22 B9R1.69 OC1=CC=C(O)C(Br)=C1 CS-0110770 [0,0,1,1,0,0|1,0,1]=4 23 B9R1.1 C=CC1=CC=C(Cl)C=N1 CS-0050535 [0,0,1,1,0,0|2,0,0]=4 24 B9R1.1 C=CC1=CC=C(N)C=C1 CS-0106396 [0,0,1,1,0,0|2,0,0]=4 25 B9R1.1 COC1=CNC(=O)C=C1 CS-0096327 [0,0,1,1,0,0|1,0,1]=4 26 B11R2.1 BrC1=CC=C2C=CN=CN12 CS-0080596 [0,0,0,1,0,1|2,0,0]=4 27 B11R2.1 O=C1NC=C2C=CC=CN12 CS-0029727 [0,0,0,1,0,1|2,0,0]=4 28 B11R2.106 BrC1=C2C=CSC2=CC=N1 CS-0081737 [0,1,0,1,0,0|1,1,0]=4 29 B11R2.106 BrC1=CN=CC2=C1OC=C2 CS-0087974 [0,1,0,1,0,0|2,0,0]=4 30 B11R2.106 BrC1=NC=CC2=C1C=CO2 CS-0087975 [0,1,0,1,0,0|1,0,0]=3 31 B11R2.106 CC1=C2C=CNC2=CC=N1 CS-0039018 [0,1,0,1,0,0|2,0,0]=4 32 B11R2.106 CC1=C2C=CNC2=NC=C1 CS-0004137 [0,1,0,1,0,0|2,0,0]=4 33 B11R2.106 CC1=CC=NC2=C1NC=C2 CS-0050001 [0,1,0,1,0,0|2,0,0]=4 34 B11R2.106 CC1=CN=CC2=C1C=CN2 CS-0050810 [0,1,0,1,0,0|2,0,0]=4 35 B11R2.106 CC1=CN=CC2=C1OC=C2 CS-0083023 [0,1,0,1,0,0|2,0,0]=4 36 B11R2.106 ClC1=C2C=COC2=CC=C1 CS-0096258 [0,1,0,1,0,0|1,0,0]=3 37 B11R2.106 ClC1=C2C=COC2=NC=C1 CS-0050889 [0,1,0,1,0,0|1,0,0]=3 38 B11R2.106 ClC1=C2C=COC2=NC=N1 CS-0050888 [0,1,0,1,0,0|2,0,0]=4 39 B11R2.106 ClC1=C2N=COC2=CC=C1 CS-0107093 [0,1,0,1,0,0|2,0,0]=4 40 B11R2.106 ClC1=CC=CC2=C1CC=C2 CS-0082116 [0,1,0,1,0,0|2,0,0]=4 41 B11R2.106 ClC1=CC=CC2=C1NC=C2 CS-W020039 [0,1,0,1,0,0|2,0,0]=4 42 B11R2.106 ClC1=CC=NC2=C1OC=C2 CS-0050039 [0,1,0,1,0,0|1,0,0]=3 43 B11R2.106 ClC1=NC=CC2=CC=CN21 CS-0101506 [0,1,0,1,0,0|2,0,0]=4 44 B11R2.106 FC1=C2C=CSC2=CC=C1 CS-0060379 [0,1,0,1,0,0|1,1,0]=4 45 B11R2.106 IC1=CC=NC2=C1C=CO2 CS-0050826 [0,1,0,1,0,0|1,0,0]=3 46 B11R2.106 NC1=C2C=COC2=NC=N1 CS-0049347 [0,1,0,1,0,0|2,0,0]=4 47 B11R2.106 NC1=C2C=CSC2=CC=N1 CS-0081734 [0,1,0,1,0,0|1,1,0]=4 48 B11R2.106 NC1=CC=NN2C=CC=C12 CS-0048720 [0,1,0,1,0,0|2,0,0]=4 49 B11R2.106 NC1=CN=CC2=C1C=CN2 CS-0091211 [0,1,0,1,0,0|2,0,0]=4 50 B11R2.106 O=C1C=CNN2C=CC=C12 CS-0052554 [0,1,0,1,0,0|2,0,0]=4 51 B11R2.106 O=C1NC=CC2=C1C=CN2 CS-W021340 [0,1,0,1,0,0|1,0,0]=3 52 B11R2.106 O=C1NC=CC2=C1C=NN2 CS-0089058 [0,1,0,1,0,0|2,0,0]=4 53 B11R2.106 O=C1NC=CC2=C1NC=C2 CS-0089902 [0,1,0,1,0,0|2,0,0]=4 54 B11R2.106 O=C1NC=CC2=C1NC=N2 CS-0005529 [0,1,0,1,0,0|2,0,0]=4 55 B11R2.106 O=C1NC=CC2=C1OC=C2 CS-0053942 [0,1,0,1,0,0|2,0,0]=4 56 B11R2.106 O=C1NCCC2=C1C=CO2 CS-0050843 [0,1,0,1,0,0|0,0,2]=4 57 B11R2.106 O=C1NN=CC2=C1C=CS2 CS-0046577 [0,1,0,1,0,0|1,1,0]=4 58 B11R2.106 OC1=C2C=CSC2=CC=N1 CS-0060295 [0,1,0,1,0,0|0,1,1]=4 59 B11R2.106 OC1=CC=CC2=C1C=CN2 CS-D1727 [0,1,0,1,0,0|1,0,1]=4 60 B11R2.10 BrC1=CC2=NC=CC=C2S1 CS-D0426 [0,1,0,1,0,0|1,1,0]=4 61 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 CS-0088486 [0,1,0,1,0,0|2,0,0]=4 62 B11R2.15 O=CC1=CC2=C(C=NN2)S1 CS-0081179 [0,1,0,1,0,0|2,0,0]=4 63 B11R2.36 BrC1=CC2=C(C=C1)C=NO2 CS-W005194 [0,1,0,1,0,0|2,0,0]=4 64 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 CS-W019162 [0,1,0,1,0,0|2,0,0]=4 65 B11R2.36 CC1=CC2=C(C=CO2)C=N1 CS-0083025 [0,1,0,1,0,0|2,0,0]=4 66 B11R2.36 CC1=CN=C2C=CNC2=C1 CS-0050168 [0,1,0,1,0,0|2,0,0]=4 67 B11R2.36 ClC1=CC2=C(C=CN2)N=C1 CS-W010946 [0,1,0,1,0,0|2,0,0]=4 68 B11R2.36 ClC1=CC2=C(C=CO2)N=C1 CS-0060717 [0,1,0,1,0,0|1,0,0]=3 69 B11R2.36 ClC1=CC=C2SC=CC2=N1 CS-0050506 [0,1,0,1,0,0|1,1,0]=4 70 B11R2.36 ClC1=NC=C2OC=CC2=N1 CS-0084402 [0,1,0,1,0,0|2,0,0]=4 71 B11R2.36 FC1=CC2=C(C=C1)OC=N2 CS-0060653 [0,1,0,1,0,0|2,0,0]=4 72 B11R2.36 IC1=CN=C2C=COC2=C1 CS-0081701 [0,1,0,1,0,0|1,0,0]=3 73 B11R2.36 NC1=CC2=C(C=C1)N=CO2 CS-W005476 [0,1,0,1,0,0|2,0,0]=4 74 B11R2.36 NC1=CC2=C(C=C1)OC=N2 CS-0038272 [0,1,0,1,0,0|2,0,0]=4 75 B11R2.36 NC1=CN=C2C=CNC2=C1 CS-0052494 [0,1,0,1,0,0|2,0,0]=4 76 B11R2.36 NC1=CN=C2OC=CC2=C1 CS-0049348 [0,1,0,1,0,0|2,0,0]=4 77 B11R2.36 OC1=CC2=C(C=CS2)C=C1 CS-0060429 [0,1,0,1,0,0|1,1,0]=4 78 B11R2.36 OC1=CC=C2OC=CC2=C1 CS-W004630 [0,1,0,1,0,0|0,0,1]=3