Molecule ID: mol7980

SMILES: Cn1c(S)nc2cnccc21

InChI: InChI=1S/C7H7N3S/c1-10-6-2-3-8-4-5(6)9-7(10)11/h2-4H,1H3,(H,9,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization