Molecule ID: mol5812

SMILES: CN1CCC(NNc2ccccc2)CC1

InChI: InChI=1S/C12H19N3/c1-15-9-7-12(8-10-15)14-13-11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.70 OCHEM 1 » 0
8.70 QSARToolbox 1 » 0
8.70 IUPAC digitized pKa 1 » 0
8.70 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization