aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44011 | 2.26 | 142.2 | C7H7FS | Fc1ccccc1CS |
|
AD44012 | 2.38 | 164.2 | C10H12O2 | CCCC(=O)c1ccc(O)cc1 |
|
AD44013 | 1.51 | 136.15 | C8H8O2 | COc1cccc(C=O)c1 |
|
AD44014 | 2.37 | 274.27 | C15H14O5 | COc1ccc(OCC(=O)c2ccc(O)cc2O)cc1 |
|
AD44015 | 2.29 | 286.28 | C16H14O5 | O=C(Cc1ccc2c(c1)OCCO2)c1ccc(O)cc1O |
|
AD44016 | 2.66 | 246.24 | C14H11O3F | O=C(Cc1ccccc1F)c1ccc(O)cc1O |
|
AD44017 | 2.29 | 249.29 | C12H11O3NS | Cc1nc(CC(=O)c2ccc(O)cc2O)cs1 |
|
AD44018 | 2.46 | 201.27 | C13H15ON | Cc1ccc2c(C)cc(=O)n(C)c2c1C |
|
AD44019 | 5.24 | 304.56 | C15H8O2NCl3 | ONc1ccc(Oc2c(Cl)cc(Cl)cc2Cl)cc1 |
|
AD44020 | 2.38 | 208.35 | C8H16O2S2 | CCSC(COC(C)=O)SCC |