Molecule ID: mol34376

SMILES: COc1cc2c(c(OC)c1OC)N=CNC2

InChI: InChI=1S/C11H14N2O3/c1-14-8-4-7-5-12-6-13-9(7)11(16-3)10(8)15-2/h4,6H,5H2,1-3H3,(H,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization