Molecule ID: mol9416

SMILES: O=C(O)CCSCC(=O)O

InChI: InChI=1S/C5H8O4S/c6-4(7)1-2-10-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.64 IUPAC digitized pKa 0 » -1
4.70 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization