Molecule ID: mol8144

SMILES: CC1=Nc2c(O)nc(O)nc2N(CCO)C1C

InChI: InChI=1S/C10H14N4O3/c1-5-6(2)14(3-4-15)8-7(11-5)9(16)13-10(17)12-8/h6,15H,3-4H2,1-2H3,(H2,12,13,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
0.50 IUPAC digitized pKa 2 » 1
9.35 IUPAC digitized pKa -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization