Molecule ID: mol36360
SMILES: O=C(O)/C=C\C(=O)Nc1ccccc1
InChI: InChI=1S/C10H9NO3/c12-9(6-7-10(13)14)11-8-4-2-1-3-5-8/h1-7H,(H,11,12)(H,13,14)/b7-6-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.08 | QSARToolbox | 0 » -1 |
| 4.13 | QSARToolbox | 0 » -1 |