Molecule ID: mol37337
SMILES: O=C(O)[C@H]1O[C@@H](Oc2ccc3ncccc3c2)[C@H](O)[C@@H](O)[C@@H]1O
InChI: InChI=1S/C15H15NO7/c17-10-11(18)13(14(20)21)23-15(12(10)19)22-8-3-4-9-7(6-8)2-1-5-16-9/h1-6,10-13,15,17-19H,(H,20,21)/t10-,11-,12+,13-,15+/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.00 | QSARToolbox | 1 » 0 |