Molecule ID: mol23699

SMILES: Cc1ccc(O)c(N)c1

InChI: InChI=1S/C7H9NO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization