Molecule ID: mol8179

SMILES: CSc1nc(N(C)C)c2ncc(O)nc2n1

InChI: InChI=1S/C9H11N5OS/c1-14(2)8-6-7(11-5(15)4-10-6)12-9(13-8)16-3/h4H,1-3H3,(H,11,12,13,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization