Molecule ID: mol7799
SMILES: c1n[nH]c2c1CCCCC2
InChI: InChI=1S/C8H12N2/c1-2-4-7-6-9-10-8(7)5-3-1/h6H,1-5H2,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.96 | IUPAC digitized pKa | 1 » 0 |
| 3.96 | AttenGpKa training set | 1 » 0 |
| 3.96 | AttenGpKa training set | 1 » 0 |