Molecule ID: mol26679

SMILES: NC(=O)c1ccc2nc3ccccc3c(N)c2c1

InChI: InChI=1S/C14H11N3O/c15-13-9-3-1-2-4-11(9)17-12-6-5-8(14(16)18)7-10(12)13/h1-7H,(H2,15,17)(H2,16,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.70 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization