Molecule ID: mol13336
SMILES: CCCCCCCCOCCN(C)C
InChI: InChI=1S/C12H27NO/c1-4-5-6-7-8-9-11-14-12-10-13(2)3/h4-12H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.87 | OCHEM | 1 » 0 |
| 8.87 | Datawarrior | 1 » 0 |
| 8.87 | AttenGpKa training set | 1 » 0 |