Molecule ID: mol2268

SMILES: CCCCS

InChI: InChI=1S/C4H10S/c1-2-3-4-5/h5H,2-4H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.66 QSARToolbox 0 » -1
10.66 OCHEM 0 » -1
10.66 Hunt 0 » -1
10.77 AttenGpKa training set 0 » -1
10.78 QSARToolbox 0 » -1
10.78 Datawarrior 0 » -1
10.78 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization