Molecule ID: mol27262
SMILES: CC(C)(C)OC(=O)NC(=O)c1ccccc1
InChI: InChI=1S/C12H15NO3/c1-12(2,3)16-11(15)13-10(14)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.30 | AttenGpKa training set | 0 » -1 |
| 10.30 | QSARToolbox | 0 » -1 |