Molecule ID: mol18676
SMILES: COc1cc(C(=O)O)ccc1Nc1c2ccccc2nc2ccccc12
InChI: InChI=1S/C21H16N2O3/c1-26-19-12-13(21(24)25)10-11-18(19)23-20-14-6-2-4-8-16(14)22-17-9-5-3-7-15(17)20/h2-12H,1H3,(H,22,23)(H,24,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.41 | Baltruschat ChEMBL | 0 » -1 |