Molecule ID: mol6718
SMILES: Cc1noc(C)c1Cc1ccccc1
InChI: InChI=1S/C12H13NO/c1-9-12(10(2)14-13-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.60 | IUPAC digitized pKa | 1 » 0 |
| -1.60 | AttenGpKa training set | 1 » 0 |