Molecule ID: mol20427
SMILES: CCCCCCCNc1c2ccc(Cl)cc2nc2ccc(OC)cc12
InChI: InChI=1S/C21H25ClN2O/c1-3-4-5-6-7-12-23-21-17-10-8-15(22)13-20(17)24-19-11-9-16(25-2)14-18(19)21/h8-11,13-14H,3-7,12H2,1-2H3,(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.50 | Baltruschat ChEMBL | 1 » 0 |