Molecule ID: mol3292
SMILES: CC(C)(C)NC1CCCCC1
InChI: InChI=1S/C10H21N/c1-10(2,3)11-9-7-5-4-6-8-9/h9,11H,4-8H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.23 | QSARToolbox | 1 » 0 |
| 11.23 | IUPAC digitized pKa | 1 » 0 |
| 11.23 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 11.23 | OCHEM | 1 » 0 |
| 11.29 | AttenGpKa training set | 1 » 0 |
| 11.34 | IUPAC digitized pKa | 1 » 0 |
| 11.34 | Datawarrior | 1 » 0 |
| 11.34 | OCHEM | 1 » 0 |
| 11.34 | QSARToolbox | 1 » 0 |
| 11.34 | QSARToolbox | 1 » 0 |