Molecule ID: mol35161

SMILES: CCC1(CC)C(=O)NC(=O)N(C(=O)c2ccccc2)C1=O

InChI: InChI=1S/C15H16N2O4/c1-3-15(4-2)12(19)16-14(21)17(13(15)20)11(18)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H,16,19,21)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.40 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization