Molecule ID: mol36316

SMILES: O=C(O)Cn1nnnc1CCn1nnc(-c2ccccc2)n1

InChI: InChI=1S/C12H12N8O2/c21-11(22)8-19-10(13-16-18-19)6-7-20-15-12(14-17-20)9-4-2-1-3-5-9/h1-5H,6-8H2,(H,21,22)

Experimental Macro pKa Values

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