0 B10R1.3 CCC1=CC=C(CN)C=C1 F-452455 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.3 CSC1=CC=C(C#N)C=C1 F-453394 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.3 CSC1=CC=C(CN)C=C1 F-452459 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.3 N#CC1=CC=C(CN)C=C1 F-368585 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 F-415537 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.1 SCC1=CC=C(Cl)N=C1 F-397071 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.3 CCC1=CC=C(C(C)N)C=C1 Q-018484 [0,1,0,0,0,0|1,0,1]=3 7 B11R1.3 CN(C)C1=CC=C(CN)C=C1 POD_19/0399 [0,1,0,0,0,0|2,0,1]=4 8 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 F-502322 [0,1,0,0,0,0|1,0,0]=2 9 B11R1.3 COC1=CC=C(C(=N)N)C=C1 Z-002943 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 F-453392 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.3 [C-]#[N+]C1=CC=C([N+](=O)[O-])C=C1 F-415538 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.83 CCNC1=CC=C(OC)C=C1 C-086047 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.279 COC1=C(F)C=C(C#N)C=C1 F-434771 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.279 COC1=CC(Br)=C(NN)C=C1 F-435442 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.279 COC1=CC=C(CO)C=C1N F-369348 [0,1,0,0,0,0|1,0,2]=4 16 B9R1.21 CCC1=CC=C(C=O)N1 F-452295 [0,0,0,0,1,0|1,0,0]=2 17 B9R1.21 CCC1=CNC(C#N)=C1 F-453690 [0,0,0,0,1,0|2,0,1]=4 18 B9R1.21 CCC1=CNC(C=O)=C1 F-453679 [0,0,0,0,1,0|1,0,0]=2 19 B9R1.21 CCN1C=C(C=O)C=N1 F-405935 [0,0,0,0,1,0|2,0,0]=3 20 B8R1.2 SCC1=CC=CN=C1 F-397069 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.2 SCC1=NC=CC=C1 F-397070 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.1 CCNC1=CC=C(Br)C=C1 C-086057 [1,1,0,0,0,0|1,0,0]=3 23 B10R1.1 CCNC1=CC=C(C)C=C1 C-086048 [1,1,0,0,0,0|0,0,1]=3 24 B10R1.1 CCNC1=CC=C(Cl)C=C1 C-086052 [1,1,0,0,0,0|1,0,0]=3 25 B10R1.1 CCNC1=CC=C(F)C=C1 C-086058 [1,1,0,0,0,0|1,0,0]=3 26 B10R1.1 COCC1=CC=C(N)C=C1 F-369205 [1,1,0,0,0,0|1,0,0]=3 27 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F-332141 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.25 CC1=CC(Br)=C(NN)C=C1 F-435443 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.25 O=CC1=CC=C(O)C=C1Cl F-453388 [1,1,0,0,0,0|1,0,0]=3 30 B10R1.176 CC1=CC=C(C#N)C=C1F F-396654 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.176 CC1=CC=C(CN)C=C1F F-396671 [1,1,0,0,0,0|1,0,1]=4 32 B10R1.176 CCC1=CC(N)=C(C)C=C1 F-453381 [1,1,0,0,0,0|0,0,1]=3 33 B10R1.176 CCC1=CC=C(N)C(S)=C1 F-495550 [1,1,0,0,0,0|1,0,0]=3 34 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 F-452457 [1,1,0,0,0,0|2,0,0]=4 35 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 F-443344 [1,1,0,0,0,0|1,0,0]=3 36 B10R1.31 CC(=O)C1=CC(C=O)=CN1 F-453458 [0,1,0,0,1,0|1,0,1]=4 37 B10R1.31 CC(C)C1=CNC(C=O)=C1 F-453613 [0,1,0,0,1,0|1,0,0]=3 38 B10R1.31 CCC1=CNC(C(=O)O)=C1 F-453701 [0,1,0,0,1,0|1,0,0]=3 39 B10R1.35 CCC1=C(Br)C=C(C=O)N1 F-452302 [0,1,0,0,1,0|1,0,0]=3 40 B10R1.35 CCC1=CN(C)C(C=O)=C1 F-453680 [0,1,0,0,1,0|1,0,0]=3 41 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 Q-004186 [0,2,0,0,0,0|2,0,0]=4 42 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 X-015860 [0,2,0,0,0,0|1,0,0]=3 43 B12R1.5 CSC1=CC=C(\C(N)=N\O)C=C1 F-453393 [0,2,0,0,0,0|1,0,1]=4 44 B12R1.6 NS(=O)(=O)C1=CC=C(CBr)C=C1 F-369062 [0,2,0,0,0,0|2,0,0]=4 45 B12R1.48 CCC1=C(Br)C=C(C(=O)Cl)C=C1 F-500277 [0,2,0,0,0,0|0,0,0]=2 46 B12R1.48 CCC1=C(Br)C=C(C(=O)O)C=C1 F-500270 [0,2,0,0,0,0|0,0,0]=2 47 B12R1.48 CCC1=C(Br)C=C(C(N)=O)C=C1 F-500273 [0,2,0,0,0,0|0,0,0]=2 48 B12R1.48 COC1=C(C)C=C(C(C)N)C=C1 F-361389 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.48 COC1=C(Cl)C=C(C(C)=O)C=C1 F-262585 [0,2,0,0,0,0|1,0,0]=3 50 B12R1.48 COC1=C(Cl)C=C(C(C)N)C=C1 F-361401 [0,2,0,0,0,0|2,0,0]=4 51 B12R1.48 COC1=C(Cl)C=C(C(C)O)C=C1 F-396294 [0,2,0,0,0,0|2,0,0]=4 52 B12R1.48 COC1=C(Cl)C=C(C(N)=O)C=C1 F-318546 [0,2,0,0,0,0|1,0,0]=3 53 B12R1.48 COC1=C(F)C=C(C(=O)Cl)C=C1 F-434768 [0,2,0,0,0,0|1,0,0]=3 54 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 F-434767 [0,2,0,0,0,0|1,0,0]=3 55 B12R1.48 COC1=C(F)C=C(C(C)O)C=C1 F-367163 [0,2,0,0,0,0|2,0,0]=4 56 B12R1.48 COC1=C(F)C=C(C(N)=O)C=C1 F-434769 [0,2,0,0,0,0|1,0,0]=3 57 B12R1.48 COC1=C(I)C=C(C(=O)Cl)C=C1 F-499297 [0,2,0,0,0,0|1,0,0]=3 58 B12R1.48 COC1=C(I)C=C(C(N)=O)C=C1 F-499296 [0,2,0,0,0,0|1,0,0]=3 59 B12R1.48 COC1=C(N)C=C(C(N)=O)C=C1 POD_26/0516 [0,2,0,0,0,0|1,0,0]=3 60 B12R1.48 NCC1=CC=C(C(=O)O)C=C1F F-396659 [0,2,0,0,0,0|1,0,0]=3 61 B12R1.48 O=C(O)C1=CC=C(CBr)C(F)=C1 F-396657 [0,2,0,0,0,0|1,0,0]=3 62 B12R1.48 O=C(O)C1=CC=C(CO)C(F)=C1 F-396658 [0,2,0,0,0,0|1,0,0]=3 63 B12R1.48 O=[N+]([O-])C1=CC=C(CBr)C(Br)=C1 F-495754 [0,2,0,0,0,0|2,0,0]=4 64 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 Q-004183 [0,2,0,0,0,0|1,0,1]=4 65 B12R1.256 CC(C)C1=CC=C(C(C)N)C=C1 Q-018633 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 F-452460 [0,2,0,0,0,0|1,0,0]=3 67 B12R1.4 CC(C)NC1=CC=C(C#N)C=C1 F-332573 [0,2,0,0,0,0|1,0,1]=4 68 B12R1.4 CC(C)OC1=CC=C(C#N)C=C1 F-393267 [0,2,0,0,0,0|1,0,1]=4 69 B12R1.71 CCCNC1=CC=C(C#N)C=C1 F-332574 [0,2,0,0,0,0|1,0,1]=4 70 B12R1.71 CCCNC1=CC=C(OC)C=C1 C-086306 [0,2,0,0,0,0|2,0,0]=4 71 B12R1.114 CCNC1=CC=C(C#N)C=C1N H-001152 [0,2,0,0,0,0|1,0,1]=4 72 B12R1.114 CCOC1=C(Br)C=C(C#N)C=C1 F-393276 [0,2,0,0,0,0|1,0,1]=4 73 B12R1.114 CCOC1=C(Cl)C=C(C#N)C=C1 F-393277 [0,2,0,0,0,0|1,0,1]=4 74 B12R1.114 CCOC1=CC=C(CO)C=C1N F-369349 [0,2,0,0,0,0|0,0,2]=4 75 B12R1.116 CCNC1=CC=C(OCC)C=C1 C-086056 [0,2,0,0,0,0|1,0,1]=4 76 B12R1.78 CCC1=CC(C#N)=C(OC)C=C1 F-431397 [0,2,0,0,0,0|2,0,0]=4 77 B10R1.2 CCC1=C(N)C(S)=CC=C1 F-495545 [0,0,1,1,0,0|1,1,0]=4 78 B12R2.44 BrCC1=CC2=C(C=C1)NC=N2 F-456684 [0,1,0,1,0,0|2,0,0]=4 79 B12R2.44 CCC1=CC2=C(C=C1)NCC2 F-453384 [0,1,0,1,0,0|1,0,1]=4 80 B12R2.44 COC1=CC2=C(C=C1)NC=N2 R-015635 [0,1,0,1,0,0|2,0,0]=4 81 B12R2.44 NCC1=CC2=C(C=C1)NCC2 F-415550 [0,1,0,1,0,0|1,0,1]=4 82 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 F-123646 [0,1,0,1,0,0|2,0,0]=4 83 B12R2.44 O=CC1=CC2=C(C=C1)NC=N2 F-456685 [0,1,0,1,0,0|1,0,1]=4 84 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 F-123652 [0,1,0,1,0,0|0,0,2]=4 85 B12R2.44 OCC1=CC2=C(C=C1)NC=N2 F-456686 [0,1,0,1,0,0|2,0,0]=4 86 B12R2.44 OCC1=CC2=C(C=C1)SC=C2 F-123659 [0,1,0,1,0,0|2,0,0]=4 87 B8R1.1 CC1=CNC(C=O)=N1 F-415848 [1,0,0,0,1,0|2,0,0]=4