Molecule ID: mol15418
SMILES: CCCCCCCN(CCCCCCC)c1ccccc1
InChI: InChI=1S/C20H35N/c1-3-5-7-9-14-18-21(19-15-10-8-6-4-2)20-16-12-11-13-17-20/h11-13,16-17H,3-10,14-15,18-19H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.33 | OCHEM | 1 » 0 |
| 3.33 | QSARToolbox | 1 » 0 |
| 3.33 | Datawarrior | 1 » 0 |