Molecule ID: mol33284
SMILES: Cc1ccnc2c(O)c(S(=O)(=O)O)ccc12
InChI: InChI=1S/C10H9NO4S/c1-6-4-5-11-9-7(6)2-3-8(10(9)12)16(13,14)15/h2-5,12H,1H3,(H,13,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.80 | OCHEM | 0 » -1 |
| 10.00 | OCHEM | -1 » -2 |