Molecule ID: mol17661

SMILES: COc1ccc(Cn2cc(C(=O)NC(C)=O)c(=O)c3c(F)ccc(F)c32)cc1

InChI: InChI=1S/C20H16F2N2O4/c1-11(25)23-20(27)14-10-24(9-12-3-5-13(28-2)6-4-12)18-16(22)8-7-15(21)17(18)19(14)26/h3-8,10H,9H2,1-2H3,(H,23,25,27)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.00 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization