Molecule ID: mol1541

SMILES: Cc1ccccc1CN(CCO)CCO

InChI: InChI=1S/C12H19NO2/c1-11-4-2-3-5-12(11)10-13(6-8-14)7-9-15/h2-5,14-15H,6-10H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.10 IUPAC digitized pKa 1 » 0
7.10 Hunt 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization