Molecule ID: mol36432

SMILES: CN(CCC(=O)O)c1ccncc1

InChI: InChI=1S/C9H12N2O2/c1-11(7-4-9(12)13)8-2-5-10-6-3-8/h2-3,5-6H,4,7H2,1H3,(H,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization