Molecule ID: mol3987
SMILES: CN(C)c1cnccn1
InChI: InChI=1S/C6H9N3/c1-9(2)6-5-7-3-4-8-6/h3-5H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.24 | IUPAC digitized pKa | 1 » 0 |
| 3.24 | OCHEM | 1 » 0 |
| 3.24 | AttenGpKa training set | 1 » 0 |
| 3.24 | QSARToolbox | 1 » 0 |