Molecule ID: mol21547

SMILES: N=C(N)NC(=O)c1ccccc1

InChI: InChI=1S/C8H9N3O/c9-8(10)11-7(12)6-4-2-1-3-5-6/h1-5H,(H4,9,10,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization