Molecule ID: mol5932
SMILES: CCCCCCCCN(CC(O)CC)CC(O)CC
InChI: InChI=1S/C16H35NO2/c1-4-7-8-9-10-11-12-17(13-15(18)5-2)14-16(19)6-3/h15-16,18-19H,4-14H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.40 | IUPAC digitized pKa | 1 » 0 |
| 6.60 | IUPAC digitized pKa | 1 » 0 |
| 7.00 | IUPAC digitized pKa | 1 » 0 |
| 7.50 | IUPAC digitized pKa | 1 » 0 |
| 7.50 | Datawarrior | 1 » 0 |
| 7.50 | OCHEM | 1 » 0 |
| 7.50 | QSARToolbox | 1 » 0 |