Molecule ID: mol16998

SMILES: CN1CC(C(=O)Nc2ccccc2)C(=O)C1=O

InChI: InChI=1S/C12H12N2O3/c1-14-7-9(10(15)12(14)17)11(16)13-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,13,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization