Molecule ID: mol37854

SMILES: CCn1cc(/C=N\O)[n+](C)c1SC

InChI: InChI=1S/C8H13N3OS/c1-4-11-6-7(5-9-12)10(2)8(11)13-3/h5-6H,4H2,1-3H3/p+1/b9-5-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.56 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization