Molecule ID: mol2962

SMILES: NC(=O)c1ccc(-c2cc(-c3ccccc3)cnc2N)cc1

InChI: InChI=1S/C18H15N3O/c19-17-16(13-6-8-14(9-7-13)18(20)22)10-15(11-21-17)12-4-2-1-3-5-12/h1-11H,(H2,19,21)(H2,20,22)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.40 Novartis 1 » 0
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Charge States and Microspecies Visualization