0 B9R1.69 BrC1=C(I)C=C(I)C=C1 AT18539 [0,0,0,0,0,0|3,1,0]=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|2,0,1]=3 3 B9R1.69 CC1=CNC(=O)C(Cl)=N1 N13244 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.69 CC1=NC(Cl)=CNC1=O F11838 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.69 CN1C=C(O)C=CC1=O P17267 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 NC1=C(F)C=CC(Cl)=N1 C90958 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 NC1=C(S)C=CC(Br)=C1 50511 [0,0,0,0,0,0|2,2,0]=4 8 B9R1.69 NC1=CC(Cl)=NN=C1N C77192 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.69 NC1=NN=C(Cl)C=C1O D76057 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.69 OC1=C(F)C=CC(Cl)=N1 CS2298 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.69 OC1=C(I)C=CC(Br)=N1 AC4863 [0,0,0,0,0,0|3,1,0]=4 12 B9R1.69 OC1=C(I)C=NC(Cl)=C1 37869 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.3 FC1=CN=C(Cl)C=N1 P20780 [1,0,0,0,0,0|2,0,1]=4 14 B8R1.3 FC1=NN=C(Cl)C=C1 O10986 [1,0,0,0,0,0|2,0,1]=4 15 B8R1.3 O=C1C=CC(Br)=CO1 D86222 [1,0,0,0,0,0|1,1,0]=3 16 B8R1.4 NC1=CC(Cl)=CN=N1 37766 [1,0,0,0,0,0|2,0,1]=4 17 B8R1.5 NC1=CC=NNC1=O 36341 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.5 NC1=CC=NNC1=S P12544 [1,0,0,0,0,0|2,1,0]=4 19 B10R1.22 CC1=C(Cl)C=C(Cl)C=C1N AC8599 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.22 CC1=CC(Cl)=CC(O)=C1I 72277 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.22 CN1C=C(I)C=C(Cl)C1=O P15202 [0,1,0,0,0,0|1,1,0]=3 22 B10R1.22 OC1=CC(F)=CC(Br)=C1F D96236 [0,1,0,0,0,0|2,1,0]=4 23 B10R1.25 CC1=CC(F)=C(C=O)N=C1 AT25473 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.25 N#CC1=NC=C(Cl)C=C1O CS3060 [0,1,0,0,0,0|1,0,1]=3 25 B10R1.25 NC1=CC(Cl)=CN=C1CO P14259 [0,1,0,0,0,0|1,0,2]=4 26 B10R1.25 O=CC1=C(Br)C=C(Cl)N=C1 CL0318 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.25 O=CC1=CN=C(Cl)C=C1F AC8394 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.30 COC1=CC(Cl)=NC=C1F 78990 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.30 COC1=CC(F)=CN=C1Br D76819 [0,1,0,0,0,0|1,1,1]=4 30 B10R1.30 COC1=CC(F)=CN=C1Cl D76820 [0,1,0,0,0,0|1,1,1]=4 31 B10R1.30 COC1=CC(F)=CN=C1N D70750 [0,1,0,0,0,0|1,1,1]=4 32 B10R1.30 ClCC1=CC(Cl)=CN=C1Br C71880 [0,1,0,0,0,0|2,0,1]=4 33 B10R1.30 N#CC1=CC(Cl)=CN=C1Br P19613 [0,1,0,0,0,0|2,0,1]=4 34 B10R1.118 CC1=C(Br)C=C(O)C(N)=C1 79590 [0,1,0,0,0,0|2,1,0]=4 35 B10R1.118 CC1=CC(O)=C(Cl)C=C1O A11096 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.118 NC1=C(Br)C=C(O)C(F)=C1 D80092 [0,1,0,0,0,0|2,1,0]=4 37 B10R1.119 CC1=C(Br)C=CC(N)=C1O P20177 [0,1,0,0,0,0|2,1,0]=4 38 B10R1.119 NC1=CC=C(Cl)C(Br)=C1Cl I11650 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.119 NC1=CC=C(Cl)C(Cl)=C1N W19346 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.119 OC1=C(F)C=CC(Br)=C1O Y14674 [0,1,0,0,0,0|2,1,0]=4 41 B10R1.176 FC1=C(Br)C=C(CCl)C=N1 C71877 [0,1,0,0,0,0|2,0,1]=4 42 B8R1.50 CC1=CNC(=O)N1C AT20167 [0,0,0,0,1,0|3,0,0]=4 43 B9R1.1 C=CC1=CNC(=O)C=C1 W19299 [1,1,0,0,0,0|1,0,0]=3 44 B9R1.3 NC1=CC=CC(O)=C1I 79304 [1,1,0,0,0,0|2,0,0]=4 45 B9R1.3 NC1=CN=CC(Cl)=C1Br AT12831 [1,1,0,0,0,0|1,0,1]=4 46 B9R1.3 O=C1C(O)=CNC=C1F P16035 [1,1,0,0,0,0|0,1,0]=3 47 B11R1.464 CC1=CC(Br)=CC(O)=C1C=O C72676 [0,2,0,0,0,0|1,1,0]=4 48 B11R1.277 COC1=CC(=O)C(C)=CC1=O A10831 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.277 O=CC1=CC(Cl)=C(Cl)C=C1F C90875 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.278 O=CC1=C(O)C(F)=C(Br)C=C1 F53695 [0,2,0,0,0,0|1,1,0]=4 51 B11R1.167 C[C@H](O)C1=CC(Cl)=CN=C1F D79305 [0,2,0,0,0,0|1,0,1]=4 52 B7R1.2 ClC1=CC(Br)=CS1 AT16572 [1,0,0,0,1,0|2,0,0]=4 53 B7R1.4 FC1=CNC=C1F P18993 [1,0,0,0,1,0|1,1,0]=4