Molecule ID: mol34381

SMILES: COc1cc2c(OCCNN)ncnc2c(OC)c1OC

InChI: InChI=1S/C13H18N4O4/c1-18-9-6-8-10(12(20-3)11(9)19-2)15-7-16-13(8)21-5-4-17-14/h6-7,17H,4-5,14H2,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.30 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization