Molecule ID: mol6473
SMILES: CN(C)c1ccccn1
InChI: InChI=1S/C7H10N2/c1-9(2)7-5-3-4-6-8-7/h3-6H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.30 | QSARToolbox | 1 » 0 |
| 6.45 | AttenGpKa training set | 1 » 0 |
| 6.98 | IUPAC digitized pKa | 1 » 0 |
| 6.99 | IUPAC digitized pKa | 1 » 0 |