Molecule ID: mol32652
SMILES: COC1CC=C2CCN3CCC(CO)C(=CCO)C23C1
InChI: InChI=1S/C16H25NO3/c1-20-14-3-2-13-5-8-17-7-4-12(11-19)15(6-9-18)16(13,17)10-14/h2,6,12,14,18-19H,3-5,7-11H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.42 | OCHEM | 1 » 0 |