Molecule ID: mol32529
SMILES: O=C(O)C1OC(Oc2ccc3cccnc3c2)C(O)C(O)C1O
InChI: InChI=1S/C15H15NO7/c17-10-11(18)13(14(20)21)23-15(12(10)19)22-8-4-3-7-2-1-5-16-9(7)6-8/h1-6,10-13,15,17-19H,(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.00 | OCHEM | 1 » 0 |
| 5.32 | OCHEM | 0 » -1 |