Molecule ID: mol17273
SMILES: O=C1NC(=O)C(Cc2ccccc2)O1
InChI: InChI=1S/C10H9NO3/c12-9-8(14-10(13)11-9)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.86 | Baltruschat ChEMBL | 0 » -1 |
| 5.94 | QSARToolbox | 0 » -1 |