Molecule ID: mol30310

SMILES: O=C1Nc2ccc(C(=O)c3cc(F)ccc3F)cc2O1

InChI: InChI=1S/C14H7F2NO3/c15-8-2-3-10(16)9(6-8)13(18)7-1-4-11-12(5-7)20-14(19)17-11/h1-6H,(H,17,19)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization