Molecule ID: mol12868
SMILES: CCCCN(C)N(C)CCCC
InChI: InChI=1S/C10H24N2/c1-5-7-9-11(3)12(4)10-8-6-2/h5-10H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.16 | OCHEM | 1 » 0 |
| 7.16 | QSARToolbox | 1 » 0 |
| 7.16 | Datawarrior | 1 » 0 |
| 7.16 | AttenGpKa training set | 1 » 0 |