Molecule ID: mol8566

SMILES: COC(=O)[C@@H](N)C(C)(C)S

InChI: InChI=1S/C6H13NO2S/c1-6(2,10)4(7)5(8)9-3/h4,10H,7H2,1-3H3/t4-/m1/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.30 IUPAC digitized pKa 1 » 0
9.17 IUPAC digitized pKa 0 » -1
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Charge States and Microspecies Visualization