Molecule ID: mol13247
SMILES: CCCCCCCNc1ccccc1
InChI: InChI=1S/C13H21N/c1-2-3-4-5-9-12-14-13-10-7-6-8-11-13/h6-8,10-11,14H,2-5,9,12H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.09 | Datawarrior | 1 » 0 |
| 5.09 | QSARToolbox | 1 » 0 |
| 5.09 | OCHEM | 1 » 0 |