Molecule ID: mol3291
SMILES: CC(N)CC1CCCCC1
InChI: InChI=1S/C9H19N/c1-8(10)7-9-5-3-2-4-6-9/h8-9H,2-7,10H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.14 | IUPAC digitized pKa | 1 » 0 |
| 10.14 | Datawarrior | 1 » 0 |
| 10.14 | OCHEM | 1 » 0 |
| 10.14 | AttenGpKa training set | 1 » 0 |