aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37091 | 0.54 | 250.25 | C13H14O5 | CC(=O)OCC1=CC2CC(=O)C3=COC(O)C1C32 |
|
AD37092 | 0.12 | 270.07 | C7H6ON6Br | NC(=NO)C1=C(Br)[N]c2ncnc(N)c21 |
|
AD37093 | 1.36 | 269.24 | C12H9O2N6 | O=c1[nH]cnc2c1N=C(N=NCc1ccc(O)cc1)[N]2 |
|
AD37094 | 1.11 | 254.35 | C12H18O2N2S | Cc1ccc(S(=O)(=O)N2CCC(N)CC2)cc1 |
|
AD37095 | 1.53 | 251.29 | C12H17O3N3 | COc1cc(N2CCC(N)CC2)ccc1[N+](=O)[O-] |
|
AD37096 | 1.0 | 243.3 | C12H21O4N | CCOC(=O)C1(C(=O)OCC)CCC(N)CC1 |
|
AD37097 | 0.72 | 245.37 | C11H21O2N2S | CC(C)(C)OC(=O)N1CC2(CC([NH3+])CS2)C1 |
|
AD37098 | 0.91 | 251.35 | C14H23O2N2 | COc1cccc(OC)c1CN1CCC([NH3+])CC1 |
|
AD37099 | 0.17 | 259.33 | C12H23O4N2 | COC(=O)C1CC([NH3+])CCN1C(=O)OC(C)(C)C |
|
AD37100 | 0.07 | 263.32 | C14H19O3N2 | COC(=O)C1CC([NH3+])CCN1C(=O)c1ccccc1 |