0 B8R1.5 NC1=C(Cl)C=CN=N1 D95227 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.3 CC1=C(Br)C=CN=C1Br 78889 [0,1,0,0,0,0|2,0,0]=3 2 B9R1.3 CC1=C(Br)C=CNC1=O P17354 [0,1,0,0,0,0|2,0,1]=4 3 B9R1.3 CC1=C(C)C(Cl)=NC=C1 C76298 [0,1,0,0,0,0|2,0,0]=3 4 B9R1.3 CC1=C(Cl)C=NN=C1Cl AC9348 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.3 CC1=NC=CC(N)=C1F C73011 [0,1,0,0,0,0|2,0,0]=3 6 B9R1.3 FC1=C(Cl)C=CN=C1Br Y10117 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.3 NC1=C(Cl)C(O)=CC=N1 68930 [0,1,0,0,0,0|3,0,0]=4 8 B9R1.3 NC1=C(F)C(F)=CC=N1 D70938 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.3 NC1=NC=CC(Br)=C1Cl AT12829 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.3 NC1=NC=CC(Br)=C1O RB1100 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.15 CC1=C(CBr)C=CN=C1 D80203 [0,1,0,0,0,0|3,0,0]=4 12 B9R1.15 CC1=C(CN)N=NC=C1 P17707 [0,1,0,0,0,0|2,0,0]=3 13 B9R1.15 CC1=C(CO)C=CN=N1 F30531 [0,1,0,0,0,0|2,0,0]=3 14 B9R1.15 CSC1=C(N)N=CC=C1 D83379 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.15 NNC1=CC=CN=C1Cl Y14739 [0,1,0,0,0,0|3,0,0]=4 16 B9R1.15 OCC1=C(Br)C=NC=N1 AC8251 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.69 CC1=C(Br)C=CC(N)=C1 D73188 [0,1,0,0,0,0|3,0,0]=4 18 B9R1.69 CC1=C(Cl)N=CC(Br)=N1 C14197 [0,1,0,0,0,0|1,0,0]=2 19 B9R1.69 CC1=CC(O)=C(N)N=C1 C15261 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.69 CC1=CC=C(F)N=C1Br C71759 [0,1,0,0,0,0|2,0,0]=3 21 B9R1.69 CC1=CC=C(O)C(F)=N1 D74688 [0,1,0,0,0,0|3,0,0]=4 22 B9R1.69 CC1=CNC(=O)C(Cl)=N1 N13244 [0,1,0,0,0,0|2,0,1]=4 23 B9R1.69 CC1=NC(Cl)=CNC1=O F11838 [0,1,0,0,0,0|1,0,1]=3 24 B9R1.69 CN1N=CC(N)=CC1=O P12529 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.69 FC1=C(F)N=C(Br)C=C1 P12799 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.69 FC1=CC=C(Br)C(I)=N1 D96928 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.69 NC1=C(Br)N=C(I)C=N1 D76508 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.69 NC1=C(F)C=CC(Cl)=N1 C90958 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.69 NC1=C(N)N=C(O)C=C1 79599 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.69 NC1=CC=C(F)N=C1I D96603 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.69 OC1=C(F)C=CC(Cl)=N1 CS2298 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.69 OC1=C(I)C=CC(Br)=N1 AC4863 [0,1,0,0,0,0|3,0,0]=4 33 B7R1.4 CC1=NNN=C1Br H10262 [0,0,0,0,1,0|2,0,0]=3 34 B7R1.4 CN1C=NN=C1Br H11179 [0,0,0,0,1,0|3,0,0]=4 35 B7R1.4 CN1CC=CC1=O N13365 [0,0,0,0,1,0|3,0,0]=4 36 B7R1.4 ClC1=C(I)SC=C1 P18106 [0,0,0,0,1,0|3,0,0]=4 37 B7R1.4 FC1=C(Br)NC=N1 73198 [0,0,0,0,1,0|2,0,1]=4 38 B7R1.4 FC1=NNC=C1Br P15391 [0,0,0,0,1,0|3,0,0]=4 39 B8R1.3 FC1=CN=C(Cl)C=N1 P20780 [1,1,0,0,0,0|1,0,0]=3 40 B8R1.4 NC1=CC(I)=NC=C1 D96556 [1,1,0,0,0,0|2,0,0]=4 41 B8R1.11 CC1=NOC=C1CN Y14820 [0,1,0,0,1,0|1,0,0]=3 42 B8R1.11 CCN1N=CC=C1O AT26527 [0,1,0,0,1,0|2,0,0]=4 43 B8R1.18 CN1C=C(Br)N=C1N D76428 [0,1,0,0,1,0|2,0,0]=4 44 B8R1.18 CN1N=C(Br)C=C1Br 97704 [0,1,0,0,1,0|2,0,0]=4 45 B8R1.18 CN1N=C(Cl)C=C1N P17875 [0,1,0,0,1,0|2,0,0]=4 46 B8R1.50 CC1=CSC(C)=C1Br O10952 [0,1,0,0,1,0|2,0,0]=4 47 B10R1.2 CC1=C(C#N)C=CN=C1Cl C10674 [0,2,0,0,0,0|2,0,0]=4 48 B10R1.2 CC1=C(C=O)C=CN=C1Cl C76531 [0,2,0,0,0,0|2,0,0]=4 49 B10R1.2 CCC1=NC=CC(C)=C1N 60037 [0,2,0,0,0,0|2,0,0]=4 50 B10R1.2 COC1=C(Br)C(Cl)=CC=N1 C71753 [0,2,0,0,0,0|2,0,0]=4 51 B10R1.2 COC1=C(Br)C(F)=CC=N1 P12279 [0,2,0,0,0,0|2,0,0]=4 52 B10R1.22 CC1=C(C)C(O)=CC(=O)N1 C76715 [0,2,0,0,0,0|1,0,1]=4 53 B10R1.22 CC1=C(C)C(O)=CC(=O)O1 D82138 [0,2,0,0,0,0|2,0,0]=4 54 B10R1.22 CC1=CC(N)=CC(Br)=C1C 55933 [0,2,0,0,0,0|2,0,0]=4 55 B10R1.22 CC1=NC(Cl)=CC(Br)=C1N D96573 [0,2,0,0,0,0|2,0,0]=4 56 B10R1.119 CC1=CC=C(C)C(N)=C1C C13892 [0,2,0,0,0,0|2,0,0]=4 57 B10R1.119 CC1=CN=C(N)C(C)=C1C D80400 [0,2,0,0,0,0|2,0,0]=4 58 B10R1.245 CC1=CC=CC(Cl)=C1CN Y11683 [0,2,0,0,0,0|2,0,0]=4 59 B10R1.245 COC1=C(F)C=CN=C1N D82404 [0,2,0,0,0,0|2,0,0]=4 60 B10R1.245 COC1=C(N)C=CN=C1C AC4530 [0,2,0,0,0,0|1,0,0]=3 61 B10R1.20 COC1=C(CCl)C=CN=N1 F30442 [0,2,0,0,0,0|2,0,0]=4 62 B10R1.20 COC1=NC=NC=C1CO F30437 [0,2,0,0,0,0|2,0,0]=4 63 B10R1.20 COC1=NN=CC=C1CO F30441 [0,2,0,0,0,0|2,0,0]=4 64 B10R1.20 NCC1=C(CO)C=CC=N1 C71511 [0,2,0,0,0,0|1,0,0]=3 65 B10R1.25 CC1=CN=C(C#N)C(Cl)=N1 D70692 [0,2,0,0,0,0|1,0,1]=4 66 B10R1.25 NC1=CC(Cl)=CN=C1CO P14259 [0,2,0,0,0,0|2,0,0]=4 67 B10R1.25 NCC1=C(Cl)C=C(F)C=N1 BL010216 [0,2,0,0,0,0|2,0,0]=4 68 B10R1.25 NCC1=NC=C(Cl)N=C1Cl D72151 [0,2,0,0,0,0|1,0,0]=3 69 B10R1.30 CC1=CC=C(N)C(CO)=N1 P12542 [0,2,0,0,0,0|2,0,0]=4 70 B10R1.30 CC1=CN=C(Cl)C(CN)=C1 79403 [0,2,0,0,0,0|2,0,0]=4 71 B10R1.30 CC1=NC(CN)=C(F)C=C1 D79767 [0,2,0,0,0,0|2,0,0]=4 72 B10R1.30 COC1=CC(F)=CN=C1Br D76819 [0,2,0,0,0,0|2,0,0]=4 73 B10R1.30 COC1=CC(F)=CN=C1Cl D76820 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.30 COC1=CC(F)=CN=C1N D70750 [0,2,0,0,0,0|2,0,0]=4 75 B10R1.30 CSC1=CC(C)=CN=C1Br D79859 [0,2,0,0,0,0|2,0,0]=4 76 B10R1.30 CSC1=CC(F)=CN=C1Br D79793 [0,2,0,0,0,0|2,0,0]=4 77 B10R1.30 ClCC1=CC(Cl)=CN=C1Br C71880 [0,2,0,0,0,0|2,0,0]=4 78 B10R1.30 N#CC1=C(Cl)N=CC(Br)=N1 91415 [0,2,0,0,0,0|1,0,1]=4 79 B10R1.30 NCC1=CC(Br)=CN=C1F 79416 [0,2,0,0,0,0|2,0,0]=4 80 B10R1.61 CN(C)C1=CC=CN=C1N W19197 [0,2,0,0,0,0|2,0,0]=4 81 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 74085 [0,2,0,0,0,0|2,0,0]=4 82 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 74087 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.61 O=[N+]([O-])C1=NC=CN=C1Cl N13177 [0,2,0,0,0,0|2,0,0]=4 84 B10R1.118 CC1=CC(N)=C(C)N=C1Cl 79484 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.176 CC1=C(C)N=C(CN)C=C1 D85900 [0,2,0,0,0,0|1,0,0]=3 86 B10R1.176 CC1=C(Cl)C=CC(C=O)=N1 D88030 [0,2,0,0,0,0|2,0,0]=4 87 B10R1.176 COC1=CN=C(Br)C(C)=N1 C72568 [0,2,0,0,0,0|1,0,0]=3 88 B6R1.2 BrC1=CC=NO1 A51037 [1,0,0,0,1,0|2,0,0]=4 89 B6R1.2 BrC1=COC=N1 AT22646 [1,0,0,0,1,0|2,0,0]=4 90 B6R1.2 FC1=CSC=C1 T72274 [1,0,0,0,1,0|2,0,0]=4 91 B6R1.2 FC1=NC=CN1 F31129 [1,0,0,0,1,0|1,0,1]=4