Molecule ID: mol25060

SMILES: CC(=O)Oc1ccccn1

InChI: InChI=1S/C7H7NO2/c1-6(9)10-7-4-2-3-5-8-7/h2-5H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization