0 B11R1.40 CCC(=O)NC1=CC=CC=C1 BB0280635 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 BB0265962 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.40 COC(=O)CC1=CN=CC=C1 BB0268341 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.40 NNC(=O)CC1=CC=CC=C1 BB0274905 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 BB0262987 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 CNCCC1=CC=NC=C1 BB0267842 [1,0,0,0,0,0|1,0,0]=2 6 B10R1.17 NCCCC1=NC=CC=C1 BB0251676 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 BB0269449 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.18 CC(=O)CC1=NC=CC=C1 BB0255238 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.18 CC(C)NC1=CC=CC=C1 BB0268013 [1,0,0,0,0,0|1,0,0]=2 10 B10R1.18 N=C(N)CC1=CC=CC=C1 BB0240259 [1,0,0,0,0,0|1,0,1]=3 11 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB0221039 [0,1,0,0,0,0|3,0,0]=4 12 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O BB0285226 [0,1,0,0,0,0|3,0,0]=4 13 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 BB0269727 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 BB0293247 [0,1,0,0,0,0|1,0,1]=3 15 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 BB0288927 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 BB0284990 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.194 CC(C)(C#N)NC1=CC=CC=C1 BB0241848 [0,1,0,0,0,0|3,0,0]=4 18 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 BB0268501 [0,0,0,1,0,0|2,0,1]=4 19 B10R1.15 CC[C@H](N)C1=CC=CC=C1 BB0293055 [0,0,0,0,1,0|2,0,0]=3 20 B10R1.15 CN(C=O)C1=CC=CC=C1 BB0258777 [0,0,0,0,1,0|3,0,0]=4 21 B10R1.15 C\C(=N/O)C1=CC=CC=C1 BB0268020 [0,0,0,0,1,0|1,0,2]=4 22 B12R1.27 COC(=O)CNC1=CC=CC=C1 BB0221448 [0,0,0,0,0,1|2,0,1]=4 23 B12R1.27 NNC(=O)CNC1=CC=CC=C1 BB0221457 [0,0,0,0,0,1|2,0,1]=4 24 B9R1.8 BrCC[N+]1=CC=CC=C1 BB0266020 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.8 CCNC1=CC=CN=C1 BB0269511 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.8 NCCC1=NC=CN=C1 BB0250750 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.8 NNCC1=CC=CC=C1 BB0219935 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.8 OCCC1=CC=CC=C1 BB0267987 [2,0,0,0,0,0|1,0,0]=3 29 B11R1.1 CCNCC1=CC=C(Cl)C=C1 BB0290024 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.17 CCNCC1=C(Cl)C=CC=C1 BB0289989 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.28 C=CCNCC1=CC=CC=C1 BB0265886 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.28 CCCNCC1=CC=CC=C1 BB0220577 [1,1,0,0,0,0|1,0,0]=3 33 B11R1.28 CCCNCC1=CC=CC=C1 BB0283704 [1,1,0,0,0,0|1,0,0]=3 34 B11R1.28 NCCCCC1=CC=NC=C1 BB0268277 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.86 CC(C)OC1=C(N)C=CC=C1 BB0292995 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.86 CN(C)CC1=C(O)C=CC=C1 BB0288892 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.509 CC(C)(O)CC1=CC=CC=C1 BB0220510 [1,1,0,0,0,0|0,0,0]=2 38 B11R1.7 C[C@](O)(CN)C1=CC=CC=C1 BB0270540 [0,1,0,0,1,0|2,0,0]=4 39 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 BB0293086 [0,1,0,0,1,0|2,0,0]=4 40 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB0242877 [0,1,0,0,1,0|1,0,1]=4 41 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 BB0242899 [0,1,0,0,1,0|1,0,1]=4 42 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 BB0288006 [0,1,0,0,1,0|1,0,1]=4 43 B13R1.14 CC[C@H](C)NCC1=CC=C(C)C=C1 BB0290055 [0,1,0,0,0,1|1,0,0]=3 44 B13R1.14 CC[C@H](C)NCC1=CC=C(F)C=C1 BB0290018 [0,1,0,0,0,1|1,0,0]=3 45 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 BB0293271 [0,1,0,0,0,1|1,0,1]=4 46 B13R1.14 CNC(=O)COC1=CC=C(C)C=C1 BB0288706 [0,1,0,0,0,1|1,0,1]=4 47 B13R1.15 CNC(=O)CCC1=CC(N)=CC=C1 BB0293297 [0,1,0,0,0,1|1,0,1]=4 48 B13R1.15 CNC(=O)COC1=CC(C)=CC=C1 BB0288709 [0,1,0,0,0,1|1,0,1]=4 49 B13R1.15 CNC(=O)COC1=CC=CC(F)=C1 BB0290225 [0,1,0,0,0,1|1,0,1]=4 50 B13R1.42 CCNC(=O)CCC1=CC=CC=C1 BB0289834 [0,1,0,0,0,1|1,0,1]=4 51 B13R1.42 CNC[C@H](O)COC1=CC=CC=C1 BB0218218 [0,1,0,0,0,1|1,0,0]=3 52 B13R1.351 CC(O)C(C)\N=C\C1=CC=CC=C1 BB0258833 [0,1,0,0,0,1|1,0,1]=4 53 B13R1.528 CC[C@H](C)NCC1=C(Br)C=CC=C1 BB0290029 [0,1,0,0,0,1|1,0,0]=3 54 B13R1.528 CC[C@H](C)NCC1=C(C)C=CC=C1 BB0290053 [0,1,0,0,0,1|1,0,0]=3 55 B13R1.528 CC[C@H](C)NCC1=C(Cl)C=CC=C1 BB0290054 [0,1,0,0,0,1|1,0,0]=3 56 B13R1.528 CNC(=O)CCC1=C(N)C=CC=C1 BB0261639 [0,1,0,0,0,1|1,0,1]=4 57 B13R1.528 CNC(=O)COC1=C(C)C=CC=C1 BB0289155 [0,1,0,0,0,1|1,0,1]=4 58 B13R1.528 CNC(=O)COC1=C(F)C=CC=C1 BB0290229 [0,1,0,0,0,1|1,0,1]=4 59 B13R1.133 CN(C)C(=O)CC1=CC=C(N)C=C1 BB0246523 [0,2,0,0,0,0|1,0,1]=4 60 B13R1.5 CC[C@H](C)OC1=CC=C(CN)C=C1 BB0292980 [0,2,0,0,0,0|2,0,0]=4 61 B13R1.146 CCN(CC)CC1=CC(N)=CC=C1 BB0267269 [0,2,0,0,0,0|2,0,0]=4 62 B13R1.91 CC[C@H](C)OC1=C(CN)C=CC=C1 BB0293051 [0,2,0,0,0,0|2,0,0]=4 63 B11R2.10 CC1=NC2=C(C=CC=C2)N1 BB0240414 [1,0,0,1,0,0|1,0,1]=4 64 B11R2.10 O=C1CC2=C(C=CC=C2)N1 BB0257524 [1,0,0,1,0,0|1,0,1]=4 65 B13R2.10 O=C1C[C@H](C2=CC=CC=C2)CN1 BB0270363 [0,0,0,1,0,1|1,0,1]=4 66 B13R2.45 CN1C(CBr)=NC2=C1C=CC=C2 BB0237093 [0,1,0,1,0,0|1,0,1]=4 67 B13R2.45 CN1C(CN)=CC2=C1C=CC=C2 BB0220043 [0,1,0,1,0,0|0,0,2]=4 68 B13R2.45 CN1C(CO)=NC2=C1C=CC=C2 BB0219484 [0,1,0,1,0,0|1,0,1]=4 69 B9R1.6 C=C(C)C1=CC=CC=C1 BB0220511 [1,0,0,0,1,0|0,0,2]=4 70 B9R1.6 C[C@H](Cl)C1=CC=CC=C1 BB0267980 [1,0,0,0,1,0|1,0,0]=3 71 B9R1.6 C[C@H](O)C1=CC=CC=C1 BB0265980 [1,0,0,0,1,0|1,0,0]=3 72 B9R1.13 C[C@H](N)CN1C=CC=N1 BB0269479 [1,0,0,0,1,0|2,0,0]=4 73 B13R1.718 CC[C@H](O)C\N=C\C1=CC=CC=C1 BB0268009 [0,0,0,0,0,2|2,0,0]=4