Molecule ID: mol4213

SMILES: COc1cc(SC)ncn1

InChI: InChI=1S/C6H8N2OS/c1-9-5-3-6(10-2)8-4-7-5/h3-4H,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization