Molecule ID: mol1575
SMILES: CC(C)CN1CCCCC1
InChI: InChI=1S/C9H19N/c1-9(2)8-10-6-4-3-5-7-10/h9H,3-8H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.44 | IUPAC digitized pKa | 1 » 0 |
| 10.44 | OCHEM | 1 » 0 |
| 10.44 | Hunt | 1 » 0 |
| 10.44 | OCHEM | 1 » 0 |
| 10.47 | AttenGpKa training set | 1 » 0 |