Molecule ID: mol32199

SMILES: O=C(C[n+]1ccc(/C=N/O)cc1)Nc1nc(-c2ccccc2)cs1

InChI: InChI=1S/C17H14N4O2S/c22-16(11-21-8-6-13(7-9-21)10-18-23)20-17-19-15(12-24-17)14-4-2-1-3-5-14/h1-10,12H,11H2,(H,19,20,22)/p+1

Experimental Macro pKa Values

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