Molecule ID: mol19320
SMILES: O=C(CCCCC(CO[N+](=O)[O-])O[N+](=O)[O-])Oc1ccccc1C(=O)O
InChI: InChI=1S/C14H16N2O10/c17-13(25-12-7-3-2-6-11(12)14(18)19)8-4-1-5-10(26-16(22)23)9-24-15(20)21/h2-3,6-7,10H,1,4-5,8-9H2,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.69 | Baltruschat ChEMBL | 0 » -1 |