Molecule ID: mol16607
SMILES: O=c1cc(-c2ccccc2)oc2cc(O)c([N+](=O)[O-])cc12
InChI: InChI=1S/C15H9NO5/c17-12-7-14(9-4-2-1-3-5-9)21-15-8-13(18)11(16(19)20)6-10(12)15/h1-8,18H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.30 | OCHEM | 0 » -1 |
| 5.30 | Baltruschat ChEMBL | 0 » -1 |