Molecule ID: mol14661
SMILES: CCCN(CC)C(CC)C(=O)Nc1c(C)cccc1C
InChI: InChI=1S/C17H28N2O/c1-6-12-19(8-3)15(7-2)17(20)18-16-13(4)10-9-11-14(16)5/h9-11,15H,6-8,12H2,1-5H3,(H,18,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.62 | QSARToolbox | 1 » 0 |
| 6.62 | OCHEM | 1 » 0 |
| 6.62 | Datawarrior | 1 » 0 |
| 7.80 | OCHEM | 1 » 0 |