Molecule ID: mol5490

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

InChI: InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization