Molecule ID: mol33578
SMILES: CCCCN(CCCC)CCOC(=O)c1ccc(N)cc1
InChI: InChI=1S/C17H28N2O2/c1-3-5-11-19(12-6-4-2)13-14-21-17(20)15-7-9-16(18)10-8-15/h7-10H,3-6,11-14,18H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.96 | OCHEM | 1 » 0 |
| 8.96 | QSARToolbox | 1 » 0 |