Molecule ID: mol5402
SMILES: NC(=O)[C@@H](N)Cc1c[nH]cn1
InChI: InChI=1S/C6H10N4O/c7-5(6(8)11)1-4-2-9-3-10-4/h2-3,5H,1,7H2,(H2,8,11)(H,9,10)/t5-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.78 | IUPAC digitized pKa | 2 » 1 |
| 7.64 | IUPAC digitized pKa | 1 » 0 |