Molecule ID: mol29651

SMILES: N#Cc1ccccc1CN1CCN(CCO)CC1

InChI: InChI=1S/C14H19N3O/c15-11-13-3-1-2-4-14(13)12-17-7-5-16(6-8-17)9-10-18/h1-4,18H,5-10,12H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization