0 B9R1.69 BrC1=C(I)C=C(I)C=C1 AT18539 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.69 CC1=C(Br)C=CC(N)=C1 D73188 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.69 CC1=CC(O)=C(N)N=C1 C15261 [0,0,0,0,0,0|1,0,1]=2 3 B9R1.69 CC1=CC=C(O)C(F)=N1 D74688 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.69 CC1=CNC(=O)C(Cl)=N1 N13244 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.69 CC1=NC(Cl)=CNC1=O F11838 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.69 CC1=NC=C(N)C(N)=C1 85235 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 CN1C=C(O)C=CC1=O P17267 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.69 NC1=C(S)C=CC(Br)=C1 50511 [0,0,0,0,0,0|3,1,0]=4 9 B9R1.69 NC1=NN=C(Cl)C=C1O D76057 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 OC1=C(F)C=CC(Cl)=N1 CS2298 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.69 OC1=C(I)C=CC(Br)=N1 AC4863 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.69 OC1=C(I)C=NC(Cl)=C1 37869 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.3 O=C1C=CC(Br)=CO1 D86222 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.5 NC1=CC=NNC1=O 36341 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.5 NC1=CC=NNC1=S P12544 [1,0,0,0,0,0|2,1,0]=4 16 B10R1.22 CC1=CC(Cl)=CC(O)=C1I 72277 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.22 CN1C=C(I)C=C(Cl)C1=O P15202 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.22 OC1=CC(F)=CC(Br)=C1F D96236 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 Y13953 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.25 CC1=CC(F)=C(C=O)N=C1 AT25473 [0,1,0,0,0,0|1,0,1]=3 21 B10R1.25 CC1=NC(N)=C(C=O)C=C1 78725 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.25 N#CC1=NC=C(Cl)C=C1O CS3060 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.30 CC1=CC=C(N)C(CO)=N1 P12542 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.30 CC1=CN=C(Cl)C(CN)=C1 79403 [0,1,0,0,0,0|2,0,1]=4 25 B10R1.30 COC1=CC(F)=CN=C1Br D76819 [0,1,0,0,0,0|2,0,1]=4 26 B10R1.30 COC1=CC(F)=CN=C1Cl D76820 [0,1,0,0,0,0|2,0,1]=4 27 B10R1.30 COC1=CC(F)=CN=C1N D70750 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.30 CSC1=CC(C)=CN=C1Br D79859 [0,1,0,0,0,0|1,1,1]=4 29 B10R1.118 CC1=C(Br)C=C(O)C(N)=C1 79590 [0,1,0,0,0,0|2,0,1]=4 30 B10R1.118 CC1=CC(I)=C(N)C=C1Br AT14614 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.118 CC1=CC(N)=C(C)N=C1Cl 79484 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.118 CC1=CC(O)=C(Cl)C=C1O A11096 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.118 NC1=C(Br)C=C(O)C(F)=C1 D80092 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.119 CC1=C(Br)C=CC(N)=C1O P20177 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.119 CC1=CC=C(C)C(N)=C1C C13892 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.119 CC1=CC=C(F)C(C)=C1Br D74747 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.119 CC1=CC=C(N)C(C)=C1I AC9073 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.119 CC1=CN=C(N)C(C)=C1C D80400 [0,1,0,0,0,0|2,0,1]=4 39 B10R1.119 OC1=C(F)C=CC(Br)=C1O Y14674 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.176 COC1=CC(Br)=C(N)N=C1 P19026 [0,1,0,0,0,0|2,0,1]=4 41 B10R1.176 FC1=C(Br)C=C(CCl)C=N1 C71877 [0,1,0,0,0,0|2,0,1]=4 42 B10R1.176 NCC1=CC(Br)=C(O)C=C1 W19427 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.176 NCC1=CN=C(Cl)C(Cl)=C1 D79849 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.176 OCC1=CC(Br)=C(F)N=C1 P17928 [0,1,0,0,0,0|2,0,1]=4 45 B8R1.50 CC1=CNC(=O)N1C AT20167 [0,0,0,0,1,0|2,0,0]=3 46 B8R1.50 CC1=CSC(C)=C1Br O10952 [0,0,0,0,1,0|3,0,0]=4 47 B9R1.1 C=CC1=CNC(=O)C=C1 W19299 [1,1,0,0,0,0|0,0,1]=3 48 B9R1.1 CC1=CN=C(C=O)N=C1 38637 [1,1,0,0,0,0|1,0,1]=4 49 B9R1.1 CC1=NN=C(C=O)C=C1 97332 [1,1,0,0,0,0|1,0,1]=4 50 B9R1.2 FC1=CC(CBr)=CN=C1 89068 [1,1,0,0,0,0|1,0,1]=4 51 B9R1.3 NC1=CC=CC(O)=C1I 79304 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.3 O=C1C(O)=CNC=C1F P16035 [1,1,0,0,0,0|1,0,0]=3 53 B11R1.32 CC1=C(C)C(=O)C(I)=C(C)N1 W12382 [0,2,0,0,0,0|2,0,0]=4 54 B11R1.464 CC1=CC(Br)=CC(O)=C1C=O C72676 [0,2,0,0,0,0|2,0,0]=4 55 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 38167 [0,2,0,0,0,0|1,0,1]=4 56 B11R1.277 CCC1=C(Br)C=C(F)C(O)=C1 70403 [0,2,0,0,0,0|2,0,0]=4 57 B11R1.277 COC1=CC(=O)C(C)=CC1=O A10831 [0,2,0,0,0,0|2,0,0]=4 58 B11R1.278 CCN1C=CC(=O)C(O)=C1C 79576 [0,2,0,0,0,0|2,0,0]=4 59 B11R1.278 O=CC1=C(O)C(F)=C(Br)C=C1 F53695 [0,2,0,0,0,0|2,0,0]=4 60 B11R1.167 CC1=CN=C(Br)C(B(O)O)=C1 79452 [0,2,0,0,0,0|1,0,1]=4 61 B11R1.167 CN1C=CC(=O)C(C(=O)O)=C1 AT13146 [0,2,0,0,0,0|2,0,0]=4 62 B11R1.280 CCC1=CN=C(Cl)C(CO)=C1 D96385 [0,2,0,0,0,0|1,0,1]=4 63 B11R1.192 C=CCC1=CC(O)=C(O)C=C1 A11902 [0,2,0,0,0,0|1,0,1]=4 64 B7R1.4 FC1=CNC=C1F P18993 [1,0,0,0,1,0|2,0,0]=4