Molecule ID: mol23763

SMILES: Nc1ccccc1C(F)(F)F

InChI: InChI=1S/C7H6F3N/c8-7(9,10)5-3-1-2-4-6(5)11/h1-4H,11H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization