Molecule ID: mol36262

SMILES: Cn1nnnc1NC(=O)c1ccccc1O

InChI: InChI=1S/C9H9N5O2/c1-14-9(11-12-13-14)10-8(16)6-4-2-3-5-7(6)15/h2-5,15H,1H3,(H,10,11,13,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.89 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization