Molecule ID: mol2594

SMILES: CCN(CC)C(=O)c1cccnc1

InChI: InChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.50 Organic Oxygen Acids and Nitrogen Bases 1 » 0
3.50 OCHEM 1 » 0
3.50 OCHEM 1 » 0
3.50 Jensen 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization