0 B10R1.22 CC1=C(C)C(O)=CC(=O)N1 C76715 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.22 CC1=C(C)C(O)=CC(=O)O1 D82138 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.22 CC1=C(Cl)C=C(Cl)C=C1N AC8599 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.22 CC1=C(O)C(=O)N=C(N)N1 C11267 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.22 CC1=CC(Cl)=CC(O)=C1I 72277 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.22 CC1=CC(N)=CC(Br)=C1C 55933 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.22 CC1=NC(Cl)=CC(Br)=C1N D96573 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.22 CC1=NC(Cl)=NC(C)=C1F AC8759 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.22 CN1C=C(I)C=C(Cl)C1=O P15202 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.22 OC1=CC(F)=CC(Br)=C1F D96236 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.3 CC1=C(C)C(Cl)=NC=C1 C76298 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.3 CC1=NC=CC(N)=C1F C73011 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.3 ClC1=C(I)C=CC=C1Br D70758 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.3 NC1=CC=CC(Br)=C1S 91081 [1,0,0,0,0,0|2,1,0]=4 14 B9R1.3 NC1=CC=CC(O)=C1I 79304 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.3 NC1=CC=CC(S)=C1Cl AT21188 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.3 NC1=NC=CC(Br)=C1O RB1100 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.34 CC1=CC(Br)=CC(F)=N1 91513 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.34 CC1=CC(F)=NC(N)=C1 W15274 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.34 CC1=CC(I)=CC(Cl)=N1 C71881 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.69 BrC1=C(I)C=C(I)C=C1 AT18539 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.69 CC1=C(Br)C=CC(N)=C1 D73188 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.69 CC1=CC(O)=C(N)N=C1 C15261 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.69 CC1=CC=C(O)C(F)=N1 D74688 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.69 CC1=NC=C(N)C(N)=C1 85235 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.69 CN1C=C(O)C=CC1=O P17267 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.69 NC1=C(S)C=CC(Br)=C1 50511 [1,0,0,0,0,0|2,1,0]=4 27 B11R1.8 CC1=CC(C#N)=C(C)C(N)=C1 C77067 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.14 COC1=NC(C)=C(O)C(C)=N1 P19909 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.32 CC1=C(C)C(=O)C(I)=C(C)N1 W12382 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.32 OC1=C(I)C=C(I)C(O)=C1I D96030 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.464 CC1=CC(Br)=CC(O)=C1C=O C72676 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.2 CC1=CC=CC(CCl)=C1F E70216 [1,1,0,0,0,0|1,0,0]=3 33 B10R1.2 CCC1=NC=CC(C)=C1N 60037 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.2 CNC1=C(N)C(C)=CC=C1 C76359 [1,1,0,0,0,0|1,0,0]=3 35 B10R1.2 NC1=C(Cl)C(CO)=CC=C1 D96960 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.2 NC1=CC=CC(CO)=C1N C74417 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.2 NCC1=CC=CC(O)=C1O D96331 [1,1,0,0,0,0|1,0,0]=3 38 B10R1.119 CC1=C(Br)C=CC(N)=C1O P20177 [1,1,0,0,0,0|1,0,0]=3 39 B10R1.119 CC1=C(F)C=CC(O)=C1N D75565 [1,1,0,0,0,0|2,0,0]=4 40 B10R1.119 CC1=CC=C(C)C(N)=C1C C13892 [1,1,0,0,0,0|1,0,0]=3 41 B10R1.119 CC1=CC=C(F)C(C)=C1Br D74747 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.119 CC1=CC=C(N)C(C)=C1I AC9073 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.119 CC1=CN=C(N)C(C)=C1C D80400 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.119 OC1=C(F)C=CC(Br)=C1O Y14674 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.245 CC1=CC=CC(Br)=C1C=O W19253 [1,1,0,0,0,0|1,0,1]=4 46 B10R1.245 CC1=CC=CC(Cl)=C1CN Y11683 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.245 CC1=CN=CC(C)=C1CO 51705 [1,1,0,0,0,0|1,0,0]=3 48 B10R1.245 COC1=C(N)C=CN=C1C AC4530 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.8 CC1=CC(Br)=CC(CN)=N1 C76956 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.8 NCC1=CC(F)=CC(O)=C1 Y14108 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 Y13953 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.30 CC1=CC=C(N)C(CO)=N1 P12542 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.30 CC1=CN=C(Cl)C(CN)=C1 79403 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.30 CC1=NC(CN)=C(F)C=C1 D79767 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.30 CSC1=CC(C)=CN=C1Br D79859 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.30 NCC1=C(O)C=CC(O)=C1 Y13730 [1,1,0,0,0,0|1,0,0]=3 57 B10R1.118 CC1=C(Br)C=C(O)C(N)=C1 79590 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.118 CC1=CC(I)=C(N)C=C1Br AT14614 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.118 CC1=CC(O)=C(Cl)C=C1O A11096 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.118 NC1=C(Br)C=C(O)C(F)=C1 D80092 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.176 CC1=C(C)N=C(CN)C=C1 D85900 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.176 COC1=CC=C(O)C(Br)=N1 F53711 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.176 NCC1=CC(Br)=C(O)C=C1 W19427 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.1005 CC(=O)C1=CC(O)=C(O)C(O)=C1 W18822 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.1000 CC1=CC(C)=NC(C)=C1[N+](=O)[O-] D96328 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.1000 CC1=CC(N)=CC(C)=C1C(=O)O 30817 [0,2,0,0,0,0|1,0,0]=3 67 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=N1 C74708 [0,2,0,0,0,0|2,0,0]=4 68 B8R1.50 CC1=CSC(C)=C1Br O10952 [1,0,0,0,1,0|2,0,0]=4