Molecule ID: mol10668

SMILES: S=c1nc[nH]c2c1CCCC2

InChI: InChI=1S/C8H10N2S/c11-8-6-3-1-2-4-7(6)9-5-10-8/h5H,1-4H2,(H,9,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.95 IUPAC digitized pKa 1 » 0
8.13 IUPAC digitized pKa 0 » -1
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Charge States and Microspecies Visualization