Molecule ID: mol5945
SMILES: CCCCCCCCCCCCCCN(CCO)CC(C)O
InChI: InChI=1S/C19H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20(16-17-21)18-19(2)22/h19,21-22H,3-18H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.80 | IUPAC digitized pKa | 1 » 0 |
| 5.20 | IUPAC digitized pKa | 1 » 0 |
| 5.60 | IUPAC digitized pKa | 1 » 0 |
| 6.30 | IUPAC digitized pKa | 1 » 0 |
| 6.30 | Datawarrior | 1 » 0 |
| 6.30 | QSARToolbox | 1 » 0 |
| 6.30 | OCHEM | 1 » 0 |