Molecule ID: mol34806

SMILES: CC(NC(O)c1ccncc1)C(=O)NCC(=O)O

InChI: InChI=1S/C11H15N3O4/c1-7(10(17)13-6-9(15)16)14-11(18)8-2-4-12-5-3-8/h2-5,7,11,14,18H,6H2,1H3,(H,13,17)(H,15,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization