Molecule ID: mol37646

SMILES: CSCC[C@@H](NC(=O)[C@@H](C)N)C(=O)O

InChI: InChI=1S/C8H16N2O3S/c1-5(9)7(11)10-6(8(12)13)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6-/m1/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.09 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization