Molecule ID: mol31521

SMILES: O/N=C/c1ccc(F)cc1

InChI: InChI=1S/C7H6FNO/c8-7-3-1-6(2-4-7)5-9-10/h1-5,10H/b9-5+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization