Molecule ID: mol28971

SMILES: CCc1ccc(OP(=O)(O)O)cc1

InChI: InChI=1S/C8H11O4P/c1-2-7-3-5-8(6-4-7)12-13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization