0 B10R1.15 C#CC(=O)C1=CC=CC=C1 BB0270313 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.15 CC[C@H](N)C1=CC=CC=C1 BB0293055 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.15 CN(C=O)C1=CC=CC=C1 BB0258777 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.15 C\C(=N/O)C1=CC=CC=C1 BB0268020 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.6 C=C(C)C1=CC=CC=C1 BB0220511 [1,0,0,0,0,0|0,0,2]=3 5 B9R1.6 C[C@H](Cl)C1=CC=CC=C1 BB0267980 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.6 C[C@H](O)C1=CC=CC=C1 BB0265980 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.6 N=C(N)C1=CC=CN=C1 BB0221335 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.6 O=C(O)C1=CC=CC=C1 BB0269653 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.6 OB(O)C1=CC=CC=C1 BB0287082 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.8 BrCC[N+]1=CC=CC=C1 BB0266020 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.8 CCNC1=CC=CN=C1 BB0269511 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.8 NCCC1=NC=CN=C1 BB0250750 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.8 NNCC1=CC=CC=C1 BB0219935 [1,0,0,0,0,0|1,0,0]=2 14 B9R1.8 OCCC1=CC=CC=C1 BB0267987 [1,0,0,0,0,0|1,0,0]=2 15 B11R1.7 C[C@](O)(CN)C1=CC=CC=C1 BB0270540 [0,1,0,0,0,0|0,0,0]=1 16 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 BB0293018 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 BB0258968 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 BB0258400 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 BB0293086 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 BB0269544 [0,1,0,0,0,0|1,0,1]=3 21 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB0240957 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB0269546 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 BB0272995 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 BB0240952 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 BB0291830 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.222 NNC(=O)C1=C(N)C=CC=C1 BB0263436 [0,1,0,0,0,0|2,0,1]=4 27 B11R2.1 N[C@H]1CCC2=NC=CC=C21 BB0268261 [0,0,0,1,0,0|3,0,0]=4 28 B9R1.11 NCC(=O)C1=CSC=C1 BB0269535 [0,0,0,0,1,0|2,0,1]=4 29 B9R1.11 NC[C@H](O)C1=CSC=C1 BB0270537 [0,0,0,0,1,0|2,0,0]=3 30 B11R1.40 CCC(=O)NC1=CC=CC=C1 BB0280635 [0,0,0,0,0,1|2,0,1]=4 31 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 BB0265962 [0,0,0,0,0,1|2,0,0]=3 32 B11R1.40 NCC(=O)NC1=CC=CC=C1 BB0254727 [0,0,0,0,0,1|1,0,1]=3 33 B11R1.40 NNC(=O)CC1=CC=CC=C1 BB0274905 [0,0,0,0,0,1|2,0,1]=4 34 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 BB0262987 [0,0,0,0,0,1|2,0,0]=3 35 B11R1.40 O=C(CBr)NC1=CC=CC=C1 BB0257989 [0,0,0,0,0,1|2,0,1]=4 36 B8R1.2 CCC1=CC=CN=C1 BB0263315 [2,0,0,0,0,0|1,0,0]=3 37 B8R1.2 COC1=CC=CC=C1 BB0266015 [2,0,0,0,0,0|1,0,0]=3 38 B8R1.2 NCC1=CC=CN=C1 BB0216501 [2,0,0,0,0,0|1,0,0]=3 39 B8R1.2 NCC1=CC=CN=N1 BB0268144 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.2 NCC1=NC=CN=C1 BB0237472 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.2 OCC1=NC=CC=C1 BB0265957 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB0254899 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.61 CN(C)C1=NC=CC=C1N BB0255044 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 BB0255227 [1,1,0,0,0,0|0,0,0]=2 45 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 BB0293257 [1,1,0,0,0,0|0,0,0]=2 46 B10R1.113 NC(=O)C1=CC(N)=CC=C1 BB0242898 [1,1,0,0,0,0|1,0,1]=4 47 B10R1.113 NC(=O)C1=CC=CC(F)=C1 BB0266818 [1,1,0,0,0,0|1,0,1]=4 48 B10R1.1 CC1=CC=C(CNN)C=C1 BB0219962 [1,1,0,0,0,0|1,0,0]=3 49 B10R1.1 N#CCC1=CC=C(N)C=C1 BB0266744 [1,1,0,0,0,0|0,0,2]=4 50 B10R1.1 NNCC1=CC=C(Cl)C=C1 BB0219968 [1,1,0,0,0,0|1,0,0]=3 51 B10R1.1 NNCC1=CC=C(F)C=C1 BB0219969 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.1 OCCC1=CC=C(F)C=C1 BB0267975 [1,1,0,0,0,0|1,0,0]=3 53 B10R1.4 CC1=C(CNN)C=CC=C1 BB0219970 [1,1,0,0,0,0|1,0,0]=3 54 B10R1.4 NCCN1N=CC=CC1=O BB0270149 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.4 NNCC1=C(Cl)C=CC=C1 BB0266305 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.10 CCNC1=CC(C)=CC=C1 BB0287324 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.10 CCOC1=CC(N)=CC=C1 BB0268130 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.10 CNCC1=CC=CC(F)=C1 BB0270505 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.10 NCCC1=CC=CC(F)=C1 BB0263137 [1,1,0,0,0,0|0,0,0]=2 60 B10R1.10 NNCC1=CC=CC(Cl)=C1 BB0262154 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.10 NNCC1=CC=CC(F)=C1 BB0270294 [1,1,0,0,0,0|1,0,0]=3 62 B10R1.17 CNCCC1=CC=NC=C1 BB0267842 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.17 NCCCC1=NC=CC=C1 BB0251676 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 BB0269449 [1,1,0,0,0,0|1,0,1]=4 65 B10R1.18 CC(C)NC1=CC=CC=C1 BB0268013 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.18 N=C(N)CC1=CC=CC=C1 BB0240259 [1,1,0,0,0,0|0,0,1]=3 67 B10R1.9 CC[C@@H](CN)N1C=CC=N1 BB0269474 [0,1,0,0,1,0|2,0,0]=4 68 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB0221039 [0,1,0,0,0,1|1,0,1]=4 69 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O BB0285226 [0,1,0,0,0,1|1,0,1]=4 70 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 BB0288927 [0,1,0,0,0,1|0,0,0]=2 71 B12R1.194 CC(C)(C#N)NC1=CC=CC=C1 BB0241848 [0,1,0,0,0,1|0,0,2]=4 72 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 BB0268511 [0,2,0,0,0,0|1,0,1]=4 73 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 BB0281884 [0,2,0,0,0,0|1,0,1]=4 74 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 BB0216516 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 BB0269597 [0,2,0,0,0,0|1,0,1]=4 76 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F BB0267449 [0,2,0,0,0,0|2,0,0]=4 77 B10R2.7 C1=CC2=C(C=C1)NN=C2 BB0219702 [1,0,0,1,0,0|1,0,1]=4 78 B12R2.18 N[C@@H]1C(=O)NC2=C1C=CC=C2 BB0270666 [0,0,0,1,0,1|1,0,1]=4 79 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 BB0219703 [0,0,0,1,0,1|1,0,1]=4 80 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 BB0219997 [0,0,0,1,0,1|0,0,2]=4 81 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 BB0270364 [0,0,0,1,0,1|0,0,2]=4 82 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 BB0219571 [0,0,0,1,0,1|1,0,1]=4 83 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 BB0256889 [0,1,0,1,0,0|2,0,0]=4 84 B12R2.2028 N[C@H]1CC(=O)C2=C1C=CC=C2 BB0216357 [0,1,0,1,0,0|1,0,1]=4 85 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 BB0269730 [0,1,0,1,0,0|2,0,0]=4 86 B12R2.1282 NC1(C2=CC=CC(F)=C2)CC1 BB0269729 [0,1,0,1,0,0|2,0,0]=4 87 B8R1.7 C[C@H](N)C1=CC=CS1 BB0221014 [1,0,0,0,1,0|1,0,0]=3 88 B8R1.8 BrCCC1=CC=CS1 BB0256668 [1,0,0,0,1,0|2,0,0]=4 89 B8R1.8 NCCC1=CSC=C1 BB0257696 [1,0,0,0,1,0|1,0,0]=3 90 B8R1.8 NCCN1C=CC=C1 BB0260251 [1,0,0,0,1,0|1,0,0]=3 91 B8R1.8 NCCN1C=CC=N1 BB0267461 [1,0,0,0,1,0|2,0,0]=4 92 B8R1.8 NCCN1C=CN=C1 BB0219897 [1,0,0,0,1,0|2,0,0]=4