Molecule ID: mol16032

SMILES: NC1CONC1=O

InChI: InChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization