Molecule ID: mol37507
SMILES: O=S(=O)(O)c1cc(O)c2c(O)c(N=Nc3nccs3)c(S(=O)(=O)O)cc2c1
InChI: InChI=1S/C13H9N3O8S3/c17-8-5-7(26(19,20)21)3-6-4-9(27(22,23)24)11(12(18)10(6)8)15-16-13-14-1-2-25-13/h1-5,17-18H,(H,19,20,21)(H,22,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.25 | QSARToolbox | 0 » -1 |