0 B10R1.4 CC1=CC=CN=C1CCN F-123630 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.4 CCNC1=C(Cl)C=CC=C1 C-086051 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.4 CNCC1=CC=CN=C1Cl F-405894 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.4 CNCC1=NC=CC=C1C F-405863 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCC1=NC=CN=C1 F-405924 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.8 N#CCC1=CN=CC=C1 F-368836 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.15 CC1=CC=CN=C1CN F-405885 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.15 COC1=C(N)C=CC=N1 F-392693 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.15 NCC1=C(N)C=CC=C1 C-015937 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.13 CCNC1=C(C)C(Cl)=CC=C1 C-086067 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.17 CCCNC1=C(Cl)C=CC=C1 C-086310 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.17 NCCSC1=C(N)C=CC=C1 POD_16/0196 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.17 [N-]=[N+]=NCC1=C(Cl)C=CC=C1 F-369325 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.81 CCNC1=C(C)C=C(C)C=C1 C-086055 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.81 N#CCC1=CC=C(Cl)C=C1Cl C-029795 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.81 OCCC1=CN=C(S)N=C1O R-035345 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.86 CC(=O)NC1=CC=CC=C1N F-137844 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.86 CC1=CC=CN=C1CC(C)N F-123581 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.86 CC1=CC=CN=C1CC(C)O F-123582 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.86 NC1=CC=CC=C1CC(=O)O F-335979 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 M-057888 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.182 CCNC1=C(C)C=CC(C)=C1 C-086066 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.182 CCOC1=C(O)C=CC(N)=C1 F-498710 [0,1,0,0,0,0|1,0,0]=2 23 B11R1.222 CCC(=O)C1=C(Cl)N=CC=C1 F-399829 [0,1,0,0,0,0|2,0,1]=4 24 B11R2.20 C1=CC=C2SCC=NC2=C1 F-399779 [0,0,0,1,0,0|1,1,1]=4 25 B9R1.33 CN1C=CC=C1CCN F-452304 [0,0,0,0,1,0|3,0,0]=4 26 B8R1.2 SCC1=CC=CN=C1 F-397069 [2,0,0,0,0,0|2,0,0]=4 27 B8R1.2 SCC1=NC=CC=C1 F-397070 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.1 CCNC1=CC=C(Br)C=C1 C-086057 [1,1,0,0,0,0|1,0,0]=3 29 B10R1.1 CCNC1=CC=C(C)C=C1 C-086048 [1,1,0,0,0,0|1,0,0]=3 30 B10R1.1 CCNC1=CC=C(Cl)C=C1 C-086052 [1,1,0,0,0,0|1,0,0]=3 31 B10R1.1 CCNC1=CC=C(F)C=C1 C-086058 [1,1,0,0,0,0|1,0,0]=3 32 B10R1.1 COCC1=CC=C(N)C=C1 F-369205 [1,1,0,0,0,0|1,0,0]=3 33 B10R1.10 CC1=CC(CCN)=NC=C1 F-123631 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.10 CC1=CC=CC(CCN)=N1 F-123632 [1,1,0,0,0,0|2,0,0]=4 35 B10R1.10 CCCC1=CC(N)=CC=C1 F-453379 [1,1,0,0,0,0|0,0,0]=2 36 B10R1.10 N#CCC1=CC=CC(Cl)=C1 C-029533 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.15 NCC(=O)C1=CC=CC=C1 POD_75/0279 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.17 CCNCC1=CC=CN=C1 M-872192 [1,1,0,0,0,0|1,0,0]=3 39 B10R1.17 N#CCSC1=CC=CC=C1 Z-097233 [1,1,0,0,0,0|1,0,1]=4 40 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 F-369319 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.18 CC(=O)CC1=NC=CC=C1 F-123574 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.18 CC(N)CC1=CC=CC=C1 F-396381 [1,1,0,0,0,0|0,0,0]=2 43 B10R1.18 CC(N)CC1=NC=CC=C1 F-123576 [1,1,0,0,0,0|1,0,0]=3 44 B10R1.18 CC(N)CC1=NC=CN=C1 F-123601 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.18 CC(O)CC1=NC=CC=C1 F-123575 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.18 CC(O)CC1=NC=CN=C1 F-123602 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.2 CCC1=C(N)C(S)=CC=C1 F-495545 [1,1,0,0,0,0|1,0,0]=3 48 B10R1.2 NC1=CC=CC(CO)=C1O F-494901 [1,1,0,0,0,0|1,0,0]=3 49 B10R1.2 NCC1=CC=CC(Cl)=C1Cl F-452458 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.30 CCC1=C(O)C=CC(N)=C1 F-498707 [1,1,0,0,0,0|0,0,0]=2 51 B10R1.30 NC1=CC(CO)=C(O)C=C1 F-494900 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.30 NCC1=C(O)C=CC(F)=C1 F-369188 [1,1,0,0,0,0|1,0,0]=3 53 B10R1.30 O=CC1=C(O)C=CC(F)=C1 F-369186 [1,1,0,0,0,0|1,0,1]=4 54 B10R1.30 OCC1=C(O)C=CC(Br)=C1 F-494871 [1,1,0,0,0,0|1,0,0]=3 55 B10R1.30 OCC1=C(O)C=CC(Cl)=C1 F-494870 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.30 OCC1=C(O)C=CC(F)=C1 F-369187 [1,1,0,0,0,0|1,0,0]=3 57 B10R1.245 NCC1=C(Cl)C=CC=C1Cl F-452456 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.25 CCCNC1=C(C)C(Cl)=CC=C1 C-086326 [0,2,0,0,0,0|1,0,0]=3 59 B12R1.40 CCOC1=C(O)C(Br)=CC(N)=C1 F-498720 [0,2,0,0,0,0|1,0,0]=3 60 B12R1.40 CCOC1=C(O)C(Cl)=CC(N)=C1 F-498711 [0,2,0,0,0,0|1,0,0]=3 61 B12R1.69 CCCNC1=C(C)C=C(C)C=C1 C-086314 [0,2,0,0,0,0|1,0,0]=3 62 B12R1.69 CCCNC1=C(F)C=C(N)C=C1 F-331723 [0,2,0,0,0,0|1,0,0]=3 63 B12R1.69 CCCNC1=CC=C(F)C=C1N F-331671 [0,2,0,0,0,0|1,0,0]=3 64 B12R1.69 NC1=CC=C(SCCO)C(Cl)=C1 F-366027 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.267 C#CCNCC1=CC=CC=C1C F-426650 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.267 C#CCNCC1=CC=CC=C1F F-426649 [0,2,0,0,0,0|1,0,1]=4 67 B12R1.267 CC1=CC=CC=C1OCCCN M-418757 [0,2,0,0,0,0|1,0,0]=3 68 B12R1.267 NCCSCC1=C(Cl)C=CC=C1 F-332718 [0,2,0,0,0,0|1,0,0]=3 69 B12R1.267 NCCSCC1=C(F)C=CC=C1 F-332721 [0,2,0,0,0,0|1,0,0]=3 70 B12R1.371 CCC(=O)NC1=C(N)C=CC=C1 F-445573 [0,2,0,0,0,0|1,0,1]=4 71 B12R1.371 CNC(C)CC1=NC=CC=C1C F-123580 [0,2,0,0,0,0|2,0,0]=4 72 B12R1.374 CCCNC1=C(C)C=CC(C)=C1 C-086325 [0,2,0,0,0,0|1,0,0]=3 73 B12R1.112 CCOC1=C(C#N)C=C(Cl)C=C1 F-433141 [0,2,0,0,0,0|2,0,0]=4 74 B12R1.112 CCOC1=C(C#N)C=C(F)C=C1 F-369195 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.112 CCOC1=C(C=O)C=C(F)C=C1 F-369162 [0,2,0,0,0,0|1,0,1]=4 76 B12R1.112 CCOC1=C(CN)C=C(F)C=C1 F-369174 [0,2,0,0,0,0|2,0,0]=4 77 B12R1.112 CCOC1=C(CO)C=C(F)C=C1 F-369168 [0,2,0,0,0,0|1,0,0]=3 78 B12R1.112 CCOC1=CC=C(Br)C=C1C#N M-154288 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.283 CCOC1=C(C(=O)O)C=CC=N1 R-063290 [0,2,0,0,0,0|2,0,0]=4 80 B12R1.114 CCNC1=CC=C(C#N)C=C1N H-001152 [0,2,0,0,0,0|2,0,0]=4 81 B12R1.114 CCOC1=C(Br)C=C(C#N)C=C1 F-393276 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.114 CCOC1=C(Cl)C=C(C#N)C=C1 F-393277 [0,2,0,0,0,0|2,0,0]=4 83 B12R1.114 CCOC1=CC=C(CO)C=C1N F-369349 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.233 CN(C)CC1=CC=C(N)C=C1Br F-495760 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.1095 CCNC1=C(C)C=C(C)C=C1C C-086062 [0,2,0,0,0,0|2,0,0]=4 86 B10R2.32 OC1=C2CCCC2=NN1 H-041588 [0,0,0,1,1,0|2,0,0]=4 87 B12R2.24 CC1=NC2=CC=CC=C2SC1 F-399780 [0,1,0,1,0,0|1,0,1]=4 88 B12R2.225 NC1=CC=CC=C1SC2CC2 F-332379 [0,1,0,1,0,0|1,0,0]=3 89 B12R2.315 NCC1=C2OCCC2=CC=C1 F-405922 [0,1,0,1,0,0|2,0,0]=4 90 B12R2.315 O=CC1=C2OCCC2=CC=C1 F-405920 [0,1,0,1,0,0|1,0,1]=4 91 B12R2.315 OCC1=C2OCCC2=CC=C1 F-405919 [0,1,0,1,0,0|1,0,0]=3 92 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 F-498490 [0,1,0,1,0,0|1,0,1]=4 93 B12R2.606 CC1=NC2=CC=C(N)C=C2O1 F-498494 [0,1,0,1,0,0|1,0,1]=4 94 B8R1.8 NCCC1=CC=CN1 F-453885 [1,0,0,0,1,0|2,0,0]=4