0 B9R1.8 CNCC1=CC=CN=C1 TL00368 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.8 CNCC1=CC=NC=C1 MO00914 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 OCCC1=CC=CN=C1 KM09875 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.2 ClCC1=NC=CC=N1 MAY00188 [1,0,0,0,0,0|2,0,0]=3 4 B8R1.2 OCC1=NC=CN=C1 CC03409 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.1 CCCC1=CN=C(Cl)N=C1 RJC02409 [0,1,0,0,0,0|3,0,0]=4 6 B10R1.1 CNCC1=CC=C(Cl)C=C1 MO00897 [0,1,0,0,0,0|2,0,0]=3 7 B10R1.1 CNCC1=NC=C(Br)C=C1 MO07896 [0,1,0,0,0,0|1,0,0]=2 8 B10R1.1 N#CCC1=CC=C(O)C=C1 SB00735 [0,1,0,0,0,0|2,0,1]=4 9 B10R1.1 OCCC1=CC=C(O)C=C1 SB01196 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.4 CNCC1=NC=CC=C1F CC30946 [0,1,0,0,0,0|1,0,0]=2 11 B10R1.10 CNCC1=CC(Br)=CN=C1 CC67146 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.10 CNCC1=CC(Cl)=NC=C1 CC53646 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.15 O=C(CBr)C1=NC=CC=C1 CC04005 [0,1,0,0,0,0|1,0,1]=3 14 B10R1.17 NCCOC1=CC=CC=C1 RF03254 [0,1,0,0,0,0|2,0,0]=3 15 B10R2.7 C1=CC2=C(C=C1)OCO2 SB00944 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.1 CC1=CC=C(CS)C=C1 TL00457 [1,1,0,0,0,0|2,0,0]=4 17 B9R1.1 COC1=CC=C(I)C=N1 NP43893 [1,1,0,0,0,0|1,0,0]=3 18 B9R1.1 OCC1=CC=C(Cl)C=C1 SB01197 [1,1,0,0,0,0|2,0,0]=4 19 B9R1.1 OCC1=NC=C(Br)C=C1 MO07897 [1,1,0,0,0,0|1,0,0]=3 20 B9R1.2 CC1=CC=CC(CS)=C1 TL00469 [1,1,0,0,0,0|2,0,0]=4 21 B9R1.2 CC1=NC(CO)=CC=C1 RJC03579 [1,1,0,0,0,0|1,0,0]=3 22 B9R1.2 CCC1=CC=CC(Br)=C1 TL00571 [1,1,0,0,0,0|1,0,0]=3 23 B9R1.2 CNC1=CC(Cl)=CC=C1 TL00250 [1,1,0,0,0,0|2,0,0]=4 24 B9R1.2 COC1=CC=CC(N)=N1 MO08464 [1,1,0,0,0,0|1,0,0]=3 25 B9R1.2 O=CC1=NC(Br)=CC=C1 MO07535 [1,1,0,0,0,0|1,0,1]=4 26 B9R1.2 OCC1=CC(Cl)=CC=C1 SB01130 [1,1,0,0,0,0|2,0,0]=4 27 B9R1.6 N=C(N)C1=CC=CC=N1 RF01042 [1,1,0,0,0,0|1,0,1]=4 28 B9R1.6 O=C(O)C1=NC=CC=C1 CC04001 [1,1,0,0,0,0|1,0,1]=4 29 B9R1.15 COC1=NC=CC=C1N SPB07839 [1,1,0,0,0,0|1,0,0]=3 30 B9R1.15 N#CC1=NC=CC=C1F MO07483 [1,1,0,0,0,0|1,0,1]=4 31 B9R1.15 O=CC1=NC=CC=C1F CC30904 [1,1,0,0,0,0|1,0,1]=4 32 B9R1.7 CC1=NC(CCN)=CS1 CC54613 [0,1,0,0,1,0|2,0,0]=4 33 B9R1.7 CC1=NC(CCO)=CS1 CC54609 [0,1,0,0,1,0|2,0,0]=4 34 B9R1.7 CNCC1=CC(C)=CS1 CC30646 [0,1,0,0,1,0|2,0,0]=4 35 B9R1.7 CNCC1=CC=C(C)S1 CC65096 [0,1,0,0,1,0|2,0,0]=4 36 B9R1.7 CNCC1=COC(C)=N1 CC57946 [0,1,0,0,1,0|2,0,0]=4 37 B9R1.7 CNCC1=CSC(C)=N1 CC05746 [0,1,0,0,1,0|2,0,0]=4 38 B9R1.7 CNCC1=NOC(C)=C1 CC10446 [0,1,0,0,1,0|2,0,0]=4 39 B9R1.12 N#CCCN1C=CC=C1 CD01949 [0,1,0,0,1,0|1,0,1]=4 40 B9R1.33 CNCC1=C(Br)OC=C1 CC64796 [0,1,0,0,1,0|2,0,0]=4 41 B9R1.33 CNCC1=C(Br)SC=C1 CC56646 [0,1,0,0,1,0|2,0,0]=4 42 B9R1.33 CNCC1=C(C)C=CO1 CC55546 [0,1,0,0,1,0|2,0,0]=4 43 B9R1.33 CNCC1=C(C)OC=C1 CC55446 [0,1,0,0,1,0|2,0,0]=4 44 B9R1.33 CNCC1=CSC=C1Br CC54296 [0,1,0,0,1,0|2,0,0]=4 45 B11R1.83 C#CC1=CC=C(CCC)C=C1 BTB09905 [0,2,0,0,0,0|1,0,0]=3 46 B11R1.83 CCC1=CC=C(CNC)C=C1 MO00891 [0,2,0,0,0,0|2,0,0]=4 47 B11R1.83 CNCC1=CC=C(OC)C=C1 MO00889 [0,2,0,0,0,0|2,0,0]=4 48 B11R1.83 N#CC1=CC=C(CCO)C=C1 TL00139 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.17 NCCOC1=CC=CC=C1Cl RF03300 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.28 NCCOCC1=CC=CC=C1 MO07103 [0,2,0,0,0,0|1,0,0]=3 51 B11R1.28 S=C=NCCC1=CC=CC=C1 TL00242 [0,2,0,0,0,0|1,0,1]=4 52 B11R1.91 CN(C)CCC1=NC=CC=C1 SB01680 [0,2,0,0,0,0|0,0,0]=2 53 B11R2.36 BrC1=CC2=C(C=C1)OCC2 CC00810 [0,1,0,1,0,0|2,0,0]=4 54 B11R2.36 NC1=CC2=C(C=C1)OCC2 NP43803 [0,1,0,1,0,0|2,0,0]=4 55 B11R2.20 C1=CC2=C(N=C1)NCCO2 CC60830 [0,1,0,1,0,0|1,0,0]=3 56 B11R2.20 C1=CC=C2OCCNC2=C1 MAY00300 [0,1,0,1,0,0|2,0,0]=4 57 B11R2.106 IC1=CC=CC2=C1OCC2 CC00911 [0,1,0,1,0,0|2,0,0]=4 58 B11R2.106 NC1=CC=CC2=C1OCC2 CC00914 [0,1,0,1,0,0|2,0,0]=4 59 B7R1.1 NCC1=CSC=C1 CC13113 [1,0,0,0,1,0|2,0,0]=4 60 B7R1.1 NCC1=NC=CS1 CC09513 [1,0,0,0,1,0|2,0,0]=4 61 B7R1.1 OCC1=NC=CN1 CC08909 [1,0,0,0,1,0|2,0,0]=4 62 B7R1.1 OCC1=NC=CS1 CC09509 [1,0,0,0,1,0|2,0,0]=4