Molecule ID: mol4710

SMILES: Nc1nc(OCc2ccccc2)c2nccnc2n1

InChI: InChI=1S/C13H11N5O/c14-13-17-11-10(15-6-7-16-11)12(18-13)19-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,16,17,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.59 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization