Molecule ID: mol11906
SMILES: O=C(O)c1cc(N=Nc2ccc(Cl)cc2)ccc1O
InChI: InChI=1S/C13H9ClN2O3/c14-8-1-3-9(4-2-8)15-16-10-5-6-12(17)11(7-10)13(18)19/h1-7,17H,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.50 | IUPAC digitized pKa | 0 » -1 |
| 11.56 | IUPAC digitized pKa | -1 » -2 |