Molecule ID: mol14076

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

InChI: InChI=1S/C7H13NO2S/c1-3-4-5-10-7(11)8-6(2)9/h3-5H2,1-2H3,(H,8,9,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization