Molecule ID: mol29477

SMILES: CC(=O)NC(Cc1c(F)c(F)c(O)c(F)c1F)C(N)=O

InChI: InChI=1S/C11H10F4N2O3/c1-3(18)17-5(11(16)20)2-4-6(12)8(14)10(19)9(15)7(4)13/h5,19H,2H2,1H3,(H2,16,20)(H,17,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization