Molecule ID: mol18173

SMILES: CNCCc1nc(-c2cn(C)c3ccccc23)no1

InChI: InChI=1S/C14H16N4O/c1-15-8-7-13-16-14(17-19-13)11-9-18(2)12-6-4-3-5-10(11)12/h3-6,9,15H,7-8H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization