Molecule ID: mol5938
SMILES: CCCCCCCCCCN(CC(C)O)CC(O)CC
InChI: InChI=1S/C17H37NO2/c1-4-6-7-8-9-10-11-12-13-18(14-16(3)19)15-17(20)5-2/h16-17,19-20H,4-15H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.60 | IUPAC digitized pKa | 1 » 0 |
| 5.80 | IUPAC digitized pKa | 1 » 0 |
| 6.40 | IUPAC digitized pKa | 1 » 0 |
| 6.70 | OCHEM | 1 » 0 |
| 6.70 | QSARToolbox | 1 » 0 |
| 6.70 | IUPAC digitized pKa | 1 » 0 |
| 6.70 | Datawarrior | 1 » 0 |