Molecule ID: mol17155
SMILES: O=c1c2ccccc2n(CCCCN2CCCCC2)c2ccc(Cl)cc12
InChI: InChI=1S/C22H25ClN2O/c23-17-10-11-21-19(16-17)22(26)18-8-2-3-9-20(18)25(21)15-7-6-14-24-12-4-1-5-13-24/h2-3,8-11,16H,1,4-7,12-15H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.36 | OCHEM | 2 » 1 |
| 5.36 | Baltruschat ChEMBL | 2 » 1 |