Molecule ID: mol15487
SMILES: CCOC(=O)C1(c2ccccc2)CCN(CC)CC1
InChI: InChI=1S/C16H23NO2/c1-3-17-12-10-16(11-13-17,15(18)19-4-2)14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.03 | OCHEM | 1 » 0 |
| 9.03 | QSARToolbox | 1 » 0 |
| 9.03 | Datawarrior | 1 » 0 |
| 9.03 | OCHEM | 1 » 0 |
| 9.03 | Baltruschat ChEMBL | 1 » 0 |