Molecule ID: mol34366
SMILES: O=C(O)c1cccc2c1C1CCC2c2cccc(O)c21
InChI: InChI=1S/C17H14O3/c18-14-6-2-4-11-9-7-8-12(16(11)14)15-10(9)3-1-5-13(15)17(19)20/h1-6,9,12,18H,7-8H2,(H,19,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.99 | QSARToolbox | 0 » -1 |
| 5.99 | QSARToolbox | 0 » -1 |