Molecule ID: mol17004

SMILES: COc1ccccc1NC(=O)C1CN(C)C(=O)C1=O

InChI: InChI=1S/C13H14N2O4/c1-15-7-8(11(16)13(15)18)12(17)14-9-5-3-4-6-10(9)19-2/h3-6,8H,7H2,1-2H3,(H,14,17)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization