Molecule ID: mol9922

SMILES: C[S+](C)CCC(N)C(=O)O

InChI: InChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization