0 B11R1.280 COC1=CC(C#N)=CC=C1C F-396663 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.280 COC1=CC(CN)=CC=C1C F-396670 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.30 CCC1=C(O)C=CC(N)=C1 F-498707 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.30 NC1=CC(CO)=C(O)C=C1 F-494900 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.30 NCC1=C(O)C=CC(F)=C1 F-369188 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.30 O=CC1=C(O)C=CC(F)=C1 F-369186 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.30 OCC1=C(O)C=CC(Br)=C1 F-494871 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.30 OCC1=C(O)C=CC(Cl)=C1 F-494870 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.30 OCC1=C(O)C=CC(F)=C1 F-369187 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.172 CNC1=NC(OC)=CC=N1 F-369387 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.172 COC1=CC=CC(CN)=C1 F-452454 [1,0,0,0,0,0|1,0,0]=2 11 B10R1.176 CC1=CC=C(CN)C=C1F F-396671 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.176 CCC1=CC(N)=C(C)C=C1 F-453381 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.176 CCC1=CC=C(N)C(S)=C1 F-495550 [1,0,0,0,0,0|1,1,0]=3 14 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 F-452457 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 M-814737 [0,1,0,0,0,0|2,0,0]=3 16 B12R1.56 COC1=CC(C(=N)N)=CC=C1C F-396664 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.56 COC1=CC(C(N)=O)=CC=C1C F-396661 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.78 CCC1=CC(C#N)=C(OC)C=C1 F-431397 [0,1,0,0,0,0|2,0,0]=3 19 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 F-431622 [0,1,0,0,0,0|3,0,0]=4 20 B12R1.453 CCC1=CC=C(O)C(C(=O)O)=C1 F-430393 [0,1,0,0,0,0|2,0,0]=3 21 B12R2.44 CCC1=CC2=C(C=C1)NCC2 F-453384 [0,0,0,1,0,0|2,0,0]=3 22 B12R2.44 NCC1=CC2=C(C=C1)NCC2 F-415550 [0,0,0,1,0,0|3,0,0]=4 23 B9R1.2 CC1=CC(CN)=NC=C1 F-405926 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.2 NCC1=CC(Cl)=CC=C1 F-452453 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.15 COC1=C(N)C=CC=N1 F-392693 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 F-443451 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.69 CC1=C(I)C=CC(Cl)=C1 F-443452 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.69 CC1=CC(N)=CC=C1O F-372365 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.69 NC1=CC(F)=C(O)C=C1 F-498709 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.69 NC1=CC=C(O)C(Br)=C1 F-498622 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.69 NC1=CC=C(O)C(Cl)=C1 F-372370 [2,0,0,0,0,0|2,0,0]=4 32 B11R1.8 CC1=CC(C=O)=C(O)C(C)=C1 M-283664 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.8 CCC1=C(O)C(Br)=CC(N)=C1 F-498716 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.8 CCC1=C(O)C(Cl)=CC(N)=C1 F-498715 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.8 COC1=C(N)C(N)=CC(Br)=C1 F-435455 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.8 COC1=C(O)C(Br)=CC(N)=C1 F-498719 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.8 COC1=C(O)C(Cl)=CC(N)=C1 F-498712 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.37 COC1=C(C#N)C=C(C)C=C1 F-431398 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 F-432055 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.37 COC1=C(C#N)C=CC(Cl)=C1 F-432017 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.37 COC1=C(C#N)C=CC(I)=C1 F-432056 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.37 COC1=C(NN)C=CC(Br)=C1 F-435445 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.167 CC(C)C1=C(O)C=CC(N)=C1 F-498708 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.167 CC1=CC=C(C)C(C(C)N)=C1 Q-018553 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.182 CCNC1=C(C)C=CC(C)=C1 C-086066 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.182 CCOC1=C(O)C=CC(N)=C1 F-498710 [1,1,0,0,0,0|1,0,0]=3 47 B11R1.9 COC1=CC(C=O)=CC(F)=C1 F-369185 [1,1,0,0,0,0|1,0,1]=4 48 B11R1.9 COC1=CC(CN)=CC(F)=C1 F-369193 [1,1,0,0,0,0|1,0,0]=3 49 B11R1.9 COC1=CC(CO)=CC(F)=C1 F-369192 [1,1,0,0,0,0|1,0,0]=3 50 B11R1.189 CCNC1=CC(OC)=CC=C1 C-086072 [1,1,0,0,0,0|0,0,0]=2 51 B11R1.189 CCNC1=NC(OC)=CC=N1 F-369395 [1,1,0,0,0,0|2,0,0]=4 52 B11R1.189 CCOC1=CC=CC(C#N)=C1 F-332609 [1,1,0,0,0,0|1,0,1]=4 53 B11R1.189 CCOC1=CC=CC(CN)=C1 F-332621 [1,1,0,0,0,0|1,0,0]=3 54 B11R1.266 CNC1=CC(C(C)=O)=CC=C1 F-502449 [1,1,0,0,0,0|1,0,1]=4 55 B11R1.266 COC1=CC(C(C)N)=CC=C1 Q-019409 [1,1,0,0,0,0|0,0,0]=2 56 B11R1.266 COC1=CC=CC(C(=N)N)=C1 F-332632 [1,1,0,0,0,0|1,0,1]=4 57 B11R1.14 CC1=CC(C=O)=CC(C)=C1O F-392782 [1,1,0,0,0,0|1,0,1]=4 58 B11R1.14 CC1=CC(CO)=CC(C)=C1O H-079314 [1,1,0,0,0,0|1,0,0]=3 59 B11R1.14 CCC1=CC(Cl)=C(N)C(N)=C1 F-498183 [1,1,0,0,0,0|2,0,0]=4 60 B11R1.14 CCC1=CC(Cl)=C(O)C(N)=C1 F-277994 [1,1,0,0,0,0|1,0,0]=3 61 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 F-262584 [1,1,0,0,0,0|1,0,1]=4 62 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 POD_15/0743 [1,1,0,0,0,0|1,0,1]=4 63 B11R1.21 CC(C)C1=CC=C(N)C(S)=C1 F-495549 [1,1,0,0,0,0|1,1,0]=4 64 B11R1.21 CC(N)C1=CC(Cl)=C(O)C=C1 F-396304 [1,1,0,0,0,0|1,0,0]=3 65 B11R1.21 CC(N)C1=CC(F)=C(N)C=C1 F-331988 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.21 CC(O)C1=CC(Cl)=C(O)C=C1 F-396293 [1,1,0,0,0,0|1,0,0]=3 67 B11R1.21 CC(O)C1=CC(F)=C(F)C=C1 F-367198 [1,1,0,0,0,0|2,0,0]=4 68 B11R1.21 CC(O)C1=CC(F)=C(N)C=C1 F-367167 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.192 CCNC1=CC(C)=C(C)C=C1 C-086053 [1,1,0,0,0,0|1,0,0]=3 70 B11R1.192 CCNC1=CC(Cl)=C(Cl)C=C1 C-086063 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.192 CCOC1=CC(N)=C(Br)C=C1 F-443459 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.192 CCOC1=CC(N)=C(Cl)C=C1 F-443460 [1,1,0,0,0,0|2,0,0]=4 73 B11R1.192 CCOC1=CC(N)=C(I)C=C1 F-443458 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.192 CCOC1=CC=C(O)C(N)=C1 F-494954 [1,1,0,0,0,0|1,0,0]=3 75 B11R1.279 COC1=CC=C(CO)C=C1N F-369348 [1,1,0,0,0,0|2,0,0]=4 76 B13R1.13 CC(O)C1=CC=C(O)C([N+](=O)[O-])=C1 F-369560 [0,2,0,0,0,0|2,0,0]=4 77 B13R1.3091 COC1=C(C#N)C=C(C(C)C)C=C1 F-431396 [0,2,0,0,0,0|2,0,0]=4 78 B13R1.3091 COC1=C(OC)C=C(C(=N)N)C=C1 F-332517 [0,2,0,0,0,0|1,0,1]=4 79 B13R1.3091 COC1=CC(C(=O)O)=CC=C1CO F-396666 [0,2,0,0,0,0|1,0,1]=4 80 B13R1.3091 COC1=CC=C(C(C)N)C=C1OC T-021888 [0,2,0,0,0,0|0,0,0]=2 81 B13R1.99 COC1=CC(OC)=C(C(C)N)C=C1 F-361443 [0,2,0,0,0,0|2,0,0]=4 82 B13R1.355 CCNC1=C(OC)C=CC(OC)=C1 C-086068 [0,2,0,0,0,0|2,0,0]=4 83 B13R1.355 CNCC1=C(OC)C=CC(OC)=C1 F-369145 [0,2,0,0,0,0|2,0,0]=4 84 B13R1.434 CCC1=CC(C#N)=C(OC)C(Br)=C1 F-431403 [0,2,0,0,0,0|2,0,0]=4 85 B13R1.434 CCC1=CC(C#N)=C(OC)C(Cl)=C1 F-431402 [0,2,0,0,0,0|2,0,0]=4 86 B13R1.2430 CCC1=CC(C(C)N)=C(CC)C=C1 F-361413 [0,2,0,0,0,0|2,0,0]=4 87 B13R1.2430 CCC1=CC=C(OC)C(C(=O)Cl)=C1 F-430437 [0,2,0,0,0,0|2,0,0]=4 88 B13R1.2430 COC1=CC(C(C)N)=C(OC)C=C1 F-361442 [0,2,0,0,0,0|2,0,0]=4 89 B13R1.97 CCC1=CC=C(O)C(NC(N)=S)=C1 F-330816 [0,2,0,0,0,0|1,0,1]=4 90 B13R1.2900 CCOC1=CC(C=O)=C(Cl)C=C1O F-392723 [0,2,0,0,0,0|1,0,1]=4 91 B13R1.437 CCC1=CC(Br)=C(O)C(C(=O)O)=C1 F-430387 [0,2,0,0,0,0|2,0,0]=4 92 B13R1.437 CCC1=CC(Cl)=C(O)C(C(=O)O)=C1 F-430392 [0,2,0,0,0,0|2,0,0]=4 93 B13R1.437 CCC1=CC(N)=C(O)C(C(=O)O)=C1 F-430398 [0,2,0,0,0,0|2,0,0]=4 94 B13R1.437 CCC1=CC([N+](=O)[O-])=C(O)C(N)=C1 F-497348 [0,2,0,0,0,0|2,0,0]=4 95 B13R2.430 N=C(N)C1=CC2=C(C=C1)OCO2 F-332512 [0,1,0,1,0,0|1,0,1]=4 96 B13R2.57 NCC1=CC2=C(C=C1)OCCO2 M-418749 [0,1,0,1,0,0|1,0,0]=3 97 B13R2.2121 CCC1=CC2=C(C=C1)NC(C)C2 F-453385 [0,1,0,1,0,0|2,0,0]=4 98 B13R2.449 CCCC1=CC2=C(C=C1)NCC2 F-453382 [0,1,0,1,0,0|2,0,0]=4 99 B13R2.449 CNCC1=CC=C2OCOC2=C1 M-872085 [0,1,0,1,0,0|0,0,0]=2