Molecule ID: mol11958
SMILES: O=C(Cc1ccccc1)N(O)c1ccccc1
InChI: InChI=1S/C14H13NO2/c16-14(11-12-7-3-1-4-8-12)15(17)13-9-5-2-6-10-13/h1-10,17H,11H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.87 | IUPAC digitized pKa | 0 » -1 |
| 8.43 | IUPAC digitized pKa | 0 » -1 |
| 8.43 | AttenGpKa training set | 0 » -1 |
| 9.80 | QSARToolbox | 0 » -1 |