Molecule ID: mol8976

SMILES: NC(=O)C(N)=S

InChI: InChI=1S/C2H4N2OS/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
11.42 IUPAC digitized pKa 0 » -1
11.47 Datawarrior 0 » -1
11.47 QSARToolbox 0 » -1
11.50 OCHEM 0 » -1
11.50 QSARToolbox 0 » -1
11.53 IUPAC digitized pKa 0 » -1
11.53 Datawarrior 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization