Molecule ID: mol24871

SMILES: COc1cc(CC(C)NN)cc(OC)c1OC

InChI: InChI=1S/C12H20N2O3/c1-8(14-13)5-9-6-10(15-2)12(17-4)11(7-9)16-3/h6-8,14H,5,13H2,1-4H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization