0 B10R1.17 CNCCC1=CC=NC=C1 BB0267842 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.17 NCCCC1=NC=CC=C1 BB0251676 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 BB0269449 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.8 BrCC[N+]1=CC=CC=C1 BB0266020 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.8 NNCC1=CC=CC=C1 BB0219935 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 OCCC1=CC=CC=C1 BB0267987 [1,0,0,0,0,0|0,0,2]=3 6 B11R1.1 C=CCOC1=CC=C(N)C=C1 BB0288128 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.1 CCNCC1=CC=C(Cl)C=C1 BB0290024 [0,1,0,0,0,0|2,0,1]=4 8 B11R1.17 C=CCOC1=C(N)C=CC=C1 BB0288977 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.17 CCNCC1=C(Cl)C=CC=C1 BB0289989 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.24 C=CCOC1=CC(N)=CC=C1 BB0293048 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.28 C=CCNCC1=CC=CC=C1 BB0265886 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.28 CCCNCC1=CC=CC=C1 BB0220577 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.28 CCCNCC1=CC=CC=C1 BB0283704 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 BB0265962 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.40 NNC(=O)CC1=CC=CC=C1 BB0274905 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 BB0262987 [0,1,0,0,0,0|1,0,2]=4 17 B11R1.91 O=C(O)CCC1=CC=NC=C1 BB0237139 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 BB0268017 [0,1,0,0,0,0|1,0,1]=3 19 B11R2.1 NC1=NOC2=C1C=CC=C2 BB0218926 [0,0,0,1,0,0|3,0,0]=4 20 B8R1.2 C=CC1=CC=CN=C1 BB0267984 [2,0,0,0,0,0|1,0,1]=4 21 B8R1.2 CCC1=CC=CN=C1 BB0263315 [2,0,0,0,0,0|1,0,1]=4 22 B8R1.2 COC1=CC=CC=C1 BB0266015 [2,0,0,0,0,0|0,0,1]=3 23 B8R1.2 NCC1=CC=CN=C1 BB0216501 [2,0,0,0,0,0|2,0,0]=4 24 B8R1.2 OCC1=CN=CN=C1 BB0268386 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.2 OCC1=NC=CC=C1 BB0265957 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.1 CC1=CC=C(CNN)C=C1 BB0219962 [1,1,0,0,0,0|2,0,0]=4 27 B10R1.1 N#CCC1=CC=C(N)C=C1 BB0266744 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.1 NNCC1=CC=C(Cl)C=C1 BB0219968 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.1 NNCC1=CC=C(F)C=C1 BB0219969 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.1 OCCC1=CC=C(F)C=C1 BB0267975 [1,1,0,0,0,0|0,0,2]=4 31 B10R1.4 CC1=C(CNN)C=CC=C1 BB0219970 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.4 NNCC1=C(Cl)C=CC=C1 BB0266305 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.10 CCOC1=CC(N)=CC=C1 BB0268130 [1,1,0,0,0,0|1,0,1]=4 34 B10R1.10 CNCC1=CC=CC(F)=C1 BB0270505 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.10 NCCC1=CC=CC(F)=C1 BB0263137 [1,1,0,0,0,0|1,0,1]=4 36 B10R1.10 NNCC1=CC=CC(Cl)=C1 BB0262154 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.10 NNCC1=CC=CC(F)=C1 BB0270294 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.15 CC[C@H](N)C1=CC=CC=C1 BB0293055 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.15 CN(C=O)C1=CC=CC=C1 BB0258777 [1,1,0,0,0,0|1,0,0]=3 40 B10R1.18 CC(=O)CC1=NC=CC=C1 BB0255238 [1,1,0,0,0,0|1,0,0]=3 41 B10R1.18 N=C(N)CC1=CC=CC=C1 BB0240259 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.18 O=C(O)CC1=CN=CC=C1 BB0259224 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.66 O=C(O)CCC1=CC=CO1 BB0256622 [0,1,0,0,1,0|2,0,0]=4 44 B12R1.1 NCCOCC1=CC=C(F)C=C1 BB0258981 [0,2,0,0,0,0|1,0,1]=4 45 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 BB0266827 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.21 CC1=CC=C(OCC(N)=O)C=C1 BB0244336 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 BB0280161 [0,2,0,0,0,0|1,0,1]=4 48 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB0270604 [0,2,0,0,0,0|1,0,0]=3 49 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 BB0267977 [0,2,0,0,0,0|1,0,0]=3 50 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 BB0221133 [0,2,0,0,0,0|2,0,0]=4 51 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 BB0217920 [0,2,0,0,0,0|2,0,0]=4 52 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 BB0269890 [0,2,0,0,0,0|2,0,0]=4 53 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 BB0290904 [0,2,0,0,0,0|1,0,1]=4 54 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 BB0267153 [0,2,0,0,0,0|1,0,1]=4 55 B12R1.69 O=CNCC1=C(Cl)C=C(Cl)C=C1 BB0293238 [0,2,0,0,0,0|1,0,0]=3 56 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 BB0281884 [0,2,0,0,0,0|1,0,0]=3 57 B12R1.125 CC(=O)\C=C\C1=C(O)C=CC=C1 BB0269827 [0,2,0,0,0,0|1,0,1]=4 58 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 BB0221119 [0,2,0,0,0,0|2,0,0]=4 59 B12R1.125 CC1=C(OCC(N)=O)C=CC=C1 BB0244334 [0,2,0,0,0,0|2,0,0]=4 60 B12R1.125 NC(=O)COC1=C(Cl)C=CC=C1 BB0293293 [0,2,0,0,0,0|2,0,0]=4 61 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 BB0290813 [0,2,0,0,0,0|1,0,0]=3 62 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 BB0284627 [0,2,0,0,0,0|2,0,0]=4 63 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 BB0281883 [0,2,0,0,0,0|1,0,1]=4 64 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 BB0217917 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.226 CC1=CC=CC(OCC(N)=O)=C1 BB0244335 [0,2,0,0,0,0|2,0,0]=4 66 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 BB0266952 [0,2,0,0,0,0|1,0,1]=4 67 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 BB0254086 [0,2,0,0,0,0|1,0,1]=4 68 B12R1.27 COC(=O)CNC1=CC=CC=C1 BB0221448 [0,2,0,0,0,0|2,0,0]=4 69 B12R1.27 NNC(=O)CNC1=CC=CC=C1 BB0221457 [0,2,0,0,0,0|2,0,0]=4 70 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 BB0289137 [0,2,0,0,0,0|1,0,0]=3 71 B12R1.252 CC(=O)NCCC1=CC=CC=C1 BB0263213 [0,2,0,0,0,0|1,0,0]=3 72 B12R1.252 O=C(O)CCOC1=CC=CC=C1 BB0267976 [0,2,0,0,0,0|1,0,0]=3 73 B12R1.252 O=C(O)CCSC1=CC=CC=C1 BB0269879 [0,2,0,0,0,0|1,0,0]=3 74 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB0221039 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O BB0285226 [0,2,0,0,0,0|2,0,0]=4 76 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 BB0269727 [0,2,0,0,0,0|1,0,0]=3 77 B12R1.891 O=S(=O)(Cl)NCC1=CC=CC=C1 BB0263218 [0,2,0,0,0,0|2,0,0]=4 78 B10R2.7 C1=CC2=C(C=C1)NN=C2 BB0219702 [1,0,0,1,0,0|2,0,0]=4 79 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 BB0219703 [0,1,0,1,0,0|2,0,0]=4 80 B12R2.1081 O=C1N=NNC2=C1C=CC=C2 BB0276440 [0,1,0,1,0,0|2,0,0]=4 81 B12R2.2028 N[C@H]1CC(=O)C2=C1C=CC=C2 BB0216357 [0,1,0,1,0,0|1,0,0]=3 82 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 BB0219951 [0,1,0,1,0,0|1,0,1]=4 83 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 BB0250594 [0,1,0,1,0,0|2,0,0]=4 84 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 BB0217042 [0,1,0,1,0,0|0,0,0]=2 85 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 BB0267948 [0,1,0,1,0,0|1,0,0]=3