Molecule ID: mol16085

SMILES: N/C(=N\O)Nc1ccc(Oc2ccc(N/C(N)=N/O)cc2)cc1

InChI: InChI=1S/C14H16N6O3/c15-13(19-21)17-9-1-5-11(6-2-9)23-12-7-3-10(4-8-12)18-14(16)20-22/h1-8,21-22H,(H3,15,17,19)(H3,16,18,20)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization