Molecule ID: mol20183
SMILES: COc1ccccc1Nc1c2ccccc2nc2ccccc12
InChI: InChI=1S/C20H16N2O/c1-23-19-13-7-6-12-18(19)22-20-14-8-2-4-10-16(14)21-17-11-5-3-9-15(17)20/h2-13H,1H3,(H,21,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.74 | Baltruschat ChEMBL | 1 » 0 |
| 7.74 | Baltruschat ChEMBL | 1 » 0 |