Molecule ID: mol14966
SMILES: COc1cccc(C(=O)CCN2CCOCC2)c1
InChI: InChI=1S/C14H19NO3/c1-17-13-4-2-3-12(11-13)14(16)5-6-15-7-9-18-10-8-15/h2-4,11H,5-10H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.10 | OCHEM | 1 » 0 |
| 7.10 | QSARToolbox | 1 » 0 |
| 7.10 | Datawarrior | 1 » 0 |