Molecule ID: mol14664
SMILES: C=CCC(C)(CN(CC)CC)OC(=O)c1ccccc1
InChI: InChI=1S/C17H25NO2/c1-5-13-17(4,14-18(6-2)7-3)20-16(19)15-11-9-8-10-12-15/h5,8-12H,1,6-7,13-14H2,2-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.80 | Datawarrior | 1 » 0 |
| 7.80 | QSARToolbox | 1 » 0 |
| 7.80 | OCHEM | 1 » 0 |