Molecule ID: mol25077

SMILES: OCc1cncc(O)c1CO

InChI: InChI=1S/C7H9NO3/c9-3-5-1-8-2-7(11)6(5)4-10/h1-2,9-11H,3-4H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization