Molecule ID: mol12705

SMILES: CCC(=O)c1nc(C(=O)O)cs1

InChI: InChI=1S/C7H7NO3S/c1-2-5(9)6-8-4(3-12-6)7(10)11/h3H,2H2,1H3,(H,10,11)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.70 Datawarrior 0 » -1
3.70 OCHEM 0 » -1
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Charge States and Microspecies Visualization