Molecule ID: mol11136

SMILES: CCCCn1c(=S)[nH]c2c[nH]c(=O)nc21

InChI: InChI=1S/C9H12N4OS/c1-2-3-4-13-7-6(11-9(13)15)5-10-8(14)12-7/h5H,2-4H2,1H3,(H,11,15)(H,10,12,14)

Experimental Macro pKa Values

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