Molecule ID: mol13952
SMILES: CCOCCNc1ccc(Cl)cc1
InChI: InChI=1S/C10H14ClNO/c1-2-13-8-7-12-10-5-3-9(11)4-6-10/h3-6,12H,2,7-8H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.28 | QSARToolbox | 1 » 0 |
| 3.28 | Datawarrior | 1 » 0 |
| 3.28 | OCHEM | 1 » 0 |