0 B9R1.69 CC1=C(Cl)C=NC(F)=C1 N12163 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.69 CC1=C(F)C=CC(S)=C1 76113 [0,0,0,0,0,0|3,1,0]=4 2 B9R1.69 CC1=CC=C(F)C(F)=N1 22779 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.69 CC1=CC=C(N)C(N)=N1 E71848 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.69 FC1=C(Cl)C=C(S)C=C1 34557 [0,0,0,0,0,0|3,1,0]=4 5 B9R1.69 FC1=CC(S)=C(F)C=C1 C13372 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 FC1=NC(F)=C(F)C=N1 75312 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 22007 [0,0,0,0,0,0|3,1,0]=4 8 B9R1.69 NC1=C(Cl)N=C(Cl)N=C1 O10597 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.69 NC1=C(N)C=C(O)C=C1 N12481 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 NC1=CC(N)=C(O)C=C1 23780 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.69 NC1=CC(N)=C(O)C=C1 D78344 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.69 NC1=CC(N)=C(O)C=C1 D90071 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.69 NC1=NN=C(Br)C(N)=N1 C90358 [0,0,0,0,0,0|2,1,1]=4 14 B9R1.69 OC1=C(F)C=NC(Cl)=N1 29151 [0,0,0,0,0,0|2,0,1]=3 15 B8R1.3 IC1=CN=C(I)C=C1 I10255 [1,0,0,0,0,0|2,1,0]=4 16 B8R1.3 NC1=CC=C(F)C=C1 D78529 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.3 NC1=CN=C(I)C=C1 C15518 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.3 NC1=CN=C(N)C=C1 A10321 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.3 NC1=CN=C(N)C=C1 O12059 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.3 NC1=CN=C(O)C=C1 A11653 [1,0,0,0,0,0|2,0,1]=4 21 B8R1.3 NC1=NC=C(O)C=C1 F16234 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.3 OC1=CN=C(O)C=C1 O12060 [1,0,0,0,0,0|2,0,1]=4 23 B8R1.3 OC1=NC=C(Cl)C=N1 36730 [1,0,0,0,0,0|0,1,2]=4 24 B8R1.4 CC1=CC=NC(O)=N1 35313 [1,0,0,0,0,0|1,0,2]=4 25 B8R1.4 CC1=CC=NC(O)=N1 W10295 [1,0,0,0,0,0|1,0,2]=4 26 B8R1.4 CC1=NC=CC(=O)N1 H10624 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.4 CC1=NC=CC(Cl)=N1 58075 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.4 NC1=CC(O)=NC=N1 30819 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.4 NC1=CC=CC(Br)=C1 D78531 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.4 O=C1C=CC=C(Br)N1 72149 [1,0,0,0,0,0|2,0,0]=3 31 B8R1.4 OC1=CC(O)=NC=C1 78320 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.4 S=C1C=CNC(=S)N1 D87918 [1,0,0,0,0,0|1,1,1]=4 33 B8R1.5 CC1=C(N)C=CC=C1 C90102 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.5 ClC1=C(Br)C=NC=N1 S11504 [1,0,0,0,0,0|1,1,1]=4 35 B8R1.5 ClC1=C(I)C=CN=C1 O10981 [1,0,0,0,0,0|2,1,0]=4 36 B8R1.5 FC1=C(Br)C=CN=C1 22405 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.5 FC1=C(Cl)C=CN=C1 22403 [1,0,0,0,0,0|2,0,0]=3 38 B8R1.5 FC1=C(F)C=CC=C1 36950 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.5 NC1=C(Br)C=CC=C1 N12017 [1,0,0,0,0,0|2,1,0]=4 40 B8R1.5 NC1=C(Br)C=CN=C1 O11194 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.5 NC1=C(N)C=CC=C1 D91918 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.5 NC1=C(S)C=CC=C1 AT19637 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.5 NC1=CC=CNC1=O D86077 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.5 O=C1NC=NC=C1Br 39336 [1,0,0,0,0,0|1,1,0]=3 45 B8R1.5 O=C1NC=NC=C1F 33701 [1,0,0,0,0,0|1,0,0]=2 46 B8R1.5 OC1=C(F)C=NC=N1 78780 [1,0,0,0,0,0|1,0,1]=3 47 B10R1.22 CC1=C(I)C(=O)NC(N)=N1 98637 [0,1,0,0,0,0|2,1,0]=4 48 B10R1.22 NC1=NC(N)=C(N)C(O)=N1 F15011 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.25 CSC1=CNC(=O)NC1=O D85984 [0,1,0,0,0,0|2,0,1]=4 50 B10R1.30 CNC1=C(F)C=NC(Cl)=N1 83982 [0,1,0,0,0,0|1,0,1]=3 51 B10R1.118 CC1=CC(F)=C(N)C=C1F 22731 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.118 CC1=CC(F)=C(N)C=C1O 35556 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.118 NC1=C(F)C=C(F)C(F)=N1 D87809 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.118 NC1=CC(N)=C(Br)C=C1F 68636 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.118 O=C1NC(Cl)=C(Br)C=C1Br C10601 [0,1,0,0,0,0|2,1,0]=4 56 B10R1.119 CC1=CC=C(F)C(N)=C1Cl 95132 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.176 CSC1=NC=C(Br)C(=O)N1 72418 [0,1,0,0,0,0|1,2,0]=4 58 B8R1.18 CC1=C(Br)N=C(Br)N1 78766 [0,0,0,0,1,0|2,1,0]=4 59 B8R1.18 CC1=C(I)NC(I)=N1 35007 [0,0,0,0,1,0|3,0,0]=4 60 B8R1.50 CC1=C(N)N(C)N=C1 C15652 [0,0,0,0,1,0|3,0,0]=4 61 B8R1.50 CC1=NNC(C)=C1N AT13383 [0,0,0,0,1,0|3,0,0]=4 62 B8R1.50 CN1N=CC(Br)=C1N W15456 [0,0,0,0,1,0|2,1,0]=4 63 B7R0.6 NC(=O)\C=C/C(N)=O D91268 [1,0,1,0,0,0|2,0,0]=4 64 B7R1.3 BrC1=CC=NC=C1 D88764 [2,0,0,0,0,0|2,0,0]=4 65 B7R1.3 ClC1=NC=NC=C1 C90125 [2,0,0,0,0,0|1,0,1]=4 66 B7R1.3 NC1=NC=NC=C1 52254 [2,0,0,0,0,0|0,0,1]=3 67 B9R1.2 C#CC1=CC=CC(=O)N1 D81685 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.2 NNC1=CC(Cl)=NC=C1 W10665 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.3 CN1C(=O)C=CC=C1Cl O11568 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.34 CC1=NC(N)=CC(=O)N1 D88439 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.34 NC1=CC(=O)N=C(N)N1 33069 [1,1,0,0,0,0|1,0,0]=3 72 B9R1.34 NC1=CC(=O)NC(Cl)=N1 30376 [1,1,0,0,0,0|2,0,0]=4 73 B9R1.34 NC1=NC(Cl)=CC(=O)N1 TD8036 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.15 CC1=C(CN)C=CN=C1 F30519 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.15 CNC1=C(Br)C=NC=C1 N10505 [1,1,0,0,0,0|1,1,0]=4 76 B9R1.23 O=CC1=CC(Br)=C(Br)N1 AC7334 [0,1,0,0,1,0|1,1,0]=4 77 B11R1.32 NC1=C(F)C(F)=NC(F)=C1Cl 80864 [0,2,0,0,0,0|2,0,0]=4 78 B11R1.464 NC1=C(C=O)C(=O)NC(=O)N1 N11853 [0,2,0,0,0,0|1,0,1]=4 79 B11R1.464 NC1=NC(=O)C(N=O)=C(N)N1 F16074 [0,2,0,0,0,0|2,0,0]=4 80 B11R1.192 CCOC1=NC=C(F)C(=O)N1 86740 [0,2,0,0,0,0|1,0,1]=4 81 B7R1.2 CC1=CC(=O)NO1 S10286 [1,0,0,0,1,0|2,0,0]=4