Molecule ID: mol29569

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

InChI: InChI=1S/C6H12O5S/c7-1-3(9)5(10)6(11)4(12)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.67 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization