Molecule ID: mol12600
SMILES: NC(Cc1ccncc1)C(=O)O
InChI: InChI=1S/C8H10N2O2/c9-7(8(11)12)5-6-1-3-10-4-2-6/h1-4,7H,5,9H2,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.22 | Datawarrior | 0 » -1 |
| 9.22 | QSARToolbox | 0 » -1 |
| 9.22 | OCHEM | 0 » -1 |