Molecule ID: mol37381

SMILES: Oc1c(O)c(CN2CCCCC2)c2ccccc2c1CN1CCCCC1

InChI: InChI=1S/C22H30N2O2/c25-21-19(15-23-11-5-1-6-12-23)17-9-3-4-10-18(17)20(22(21)26)16-24-13-7-2-8-14-24/h3-4,9-10,25-26H,1-2,5-8,11-16H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization