Molecule ID: mol19222
SMILES: O=C(NC1=C(c2ccoc2)C(=O)c2ccccc2C1=O)c1ccccc1
InChI: InChI=1S/C21H13NO4/c23-19-15-8-4-5-9-16(15)20(24)18(17(19)14-10-11-26-12-14)22-21(25)13-6-2-1-3-7-13/h1-12H,(H,22,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.10 | OCHEM | 0 » -1 |
| 12.10 | Baltruschat ChEMBL | 0 » -1 |