Molecule ID: mol19262
SMILES: CN(C)CCSc1cc(-c2ccc3ccccc3c2)nc2ccccc12
InChI: InChI=1S/C23H22N2S/c1-25(2)13-14-26-23-16-22(24-21-10-6-5-9-20(21)23)19-12-11-17-7-3-4-8-18(17)15-19/h3-12,15-16H,13-14H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.40 | Baltruschat ChEMBL | 2 » 1 |