Molecule ID: mol13679

SMILES: Nc1ncc([N+](=O)[O-])s1

InChI: InChI=1S/C3H3N3O2S/c4-3-5-1-2(9-3)6(7)8/h1H,(H2,4,5)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
0.61 Datawarrior 1 » 0
0.61 OCHEM 1 » 0
0.61 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization