Molecule ID: mol29605

SMILES: CC(C)C(/N=C/c1ccccc1O)C(=O)O

InChI: InChI=1S/C12H15NO3/c1-8(2)11(12(15)16)13-7-9-5-3-4-6-10(9)14/h3-8,11,14H,1-2H3,(H,15,16)/b13-7+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization