Molecule ID: mol14784
SMILES: CN1CCC2Cc3ccc(O)c(O)c3C3CCCC1C23
InChI: InChI=1S/C17H23NO2/c1-18-8-7-11-9-10-5-6-14(19)17(20)16(10)12-3-2-4-13(18)15(11)12/h5-6,11-13,15,19-20H,2-4,7-9H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.58 | OCHEM | 1 » 0 |
| 7.58 | QSARToolbox | 1 » 0 |
| 7.58 | Datawarrior | 1 » 0 |