Molecule ID: mol37454

SMILES: CCC(C)(S)[C@H](NC(C)=O)C(=O)O

InChI: InChI=1S/C8H15NO3S/c1-4-8(3,13)6(7(11)12)9-5(2)10/h6,13H,4H2,1-3H3,(H,9,10)(H,11,12)/t6-,8?/m1/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.30 QSARToolbox -1 » -2
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Charge States and Microspecies Visualization