Molecule ID: mol23911

SMILES: Nc1cccc(C(F)(F)C(F)(F)F)c1

InChI: InChI=1S/C8H6F5N/c9-7(10,8(11,12)13)5-2-1-3-6(14)4-5/h1-4H,14H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization