Molecule ID: mol23395
SMILES: O=C(O)CNC(=O)Cc1ccccc1
InChI: InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.67 | AttenGpKa training set | 0 » -1 |
| 3.67 | QSARToolbox | 0 » -1 |