Molecule ID: mol37022

SMILES: C[N+](C)(C)c1ccccc1C(=NO)C(F)(F)F

InChI: InChI=1S/C11H13F3N2O/c1-16(2,3)9-7-5-4-6-8(9)10(15-17)11(12,13)14/h4-7H,1-3H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.38 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization