Molecule ID: mol11593
SMILES: CC(=O)C(N)C(=O)OCc1ccccc1
InChI: InChI=1S/C11H13NO3/c1-8(13)10(12)11(14)15-7-9-5-3-2-4-6-9/h2-6,10H,7,12H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.20 | QSARToolbox | 1 » 0 |
| 5.20 | IUPAC digitized pKa | 1 » 0 |
| 11.00 | IUPAC digitized pKa | 0 » -1 |