Molecule ID: mol32194

SMILES: Cc1ccc(-c2csc(NC(=O)C[n+]3ccc(/C=N/O)cc3)n2)cc1

InChI: InChI=1S/C18H16N4O2S/c1-13-2-4-15(5-3-13)16-12-25-18(20-16)21-17(23)11-22-8-6-14(7-9-22)10-19-24/h2-10,12H,11H2,1H3,(H,20,21,23)/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.38 OCHEM 0 » -1
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Charge States and Microspecies Visualization