Molecule ID: mol31282

SMILES: O=C1c2ccc(S(=O)O)cc2-c2ccccc2C1(O)O

InChI: InChI=1S/C14H10O5S/c15-13-10-6-5-8(20(18)19)7-11(10)9-3-1-2-4-12(9)14(13,16)17/h1-7,16-17H,(H,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.65 AttenGpKa training set -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization