Molecule ID: mol2491
SMILES: C#CCN(CC)CC
InChI: InChI=1S/C7H13N/c1-4-7-8(5-2)6-3/h1H,5-7H2,2-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.97 | IUPAC digitized pKa | 1 » 0 |
| 7.97 | OCHEM | 1 » 0 |
| 7.97 | Hunt | 1 » 0 |
| 7.97 | AttenGpKa training set | 1 » 0 |