Molecule ID: mol34134
SMILES: COC(=O)C(C)(C)c1c(C)c(C)cc(C)c1C(=O)O
InChI: InChI=1S/C15H20O4/c1-8-7-9(2)11(13(16)17)12(10(8)3)15(4,5)14(18)19-6/h7H,1-6H3,(H,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.74 | QSARToolbox | 0 » -1 |
| 3.74 | QSARToolbox | 0 » -1 |