Molecule ID: mol11075
SMILES: CN(C)Cc1ccc(O)cc1
InChI: InChI=1S/C9H13NO/c1-10(2)7-8-3-5-9(11)6-4-8/h3-6,11H,7H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.83 | OCHEM | 1 » 0 |
| 8.83 | QSARToolbox | 1 » 0 |
| 8.83 | IUPAC digitized pKa | 1 » 0 |
| 8.83 | Datawarrior | 1 » 0 |
| 8.83 | AttenGpKa training set | 1 » 0 |