Molecule ID: mol5456
SMILES: CCOC(=O)CNc1cccc(C(C)=O)c1
InChI: InChI=1S/C12H15NO3/c1-3-16-12(15)8-13-11-6-4-5-10(7-11)9(2)14/h4-7,13H,3,8H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.02 | IUPAC digitized pKa | 1 » 0 |
| 1.02 | AttenGpKa training set | 1 » 0 |