Molecule ID: mol11428

SMILES: CC(C)(C)CCN(CC(=O)O)CC(=O)O

InChI: InChI=1S/C10H19NO4/c1-10(2,3)4-5-11(6-8(12)13)7-9(14)15/h4-7H2,1-3H3,(H,12,13)(H,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization