Molecule ID: mol26711

SMILES: CCOc1ccc2nc3cc(N)ccc3c(N)c2c1

InChI: InChI=1S/C15H15N3O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13/h3-8H,2,16H2,1H3,(H2,17,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.50 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization