Molecule ID: mol6971

SMILES: CNc1ccc(SC)nn1

InChI: InChI=1S/C6H9N3S/c1-7-5-3-4-6(10-2)9-8-5/h3-4H,1-2H3,(H,7,8)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.94 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization