Molecule ID: mol13327
SMILES: NC(=O)[C@@H](N)CSSC[C@H](N)C(N)=O
InChI: InChI=1S/C6H14N4O2S2/c7-3(5(9)11)1-13-14-2-4(8)6(10)12/h3-4H,1-2,7-8H2,(H2,9,11)(H2,10,12)/t3-,4-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.93 | QSARToolbox | 1 » 0 |
| 6.41 | Datawarrior | 1 » 0 |