Molecule ID: mol7485

SMILES: CNc1cc(S)ncn1

InChI: InChI=1S/C5H7N3S/c1-6-4-2-5(9)8-3-7-4/h2-3H,1H3,(H2,6,7,8,9)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
-0.27 IUPAC digitized pKa 1 » 0
9.64 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization