Molecule ID: mol36547

SMILES: CNCc1cc(O)ns1

InChI: InChI=1S/C5H8N2OS/c1-6-3-4-2-5(8)7-9-4/h2,6H,3H2,1H3,(H,7,8)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.40 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization