Molecule ID: mol29386

SMILES: O=C(O)c1ccc(C2NC(C(=O)O)CS2)cc1

InChI: InChI=1S/C11H11NO4S/c13-10(14)7-3-1-6(2-4-7)9-12-8(5-17-9)11(15)16/h1-4,8-9,12H,5H2,(H,13,14)(H,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.01 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization