Molecule ID: mol20590

SMILES: CCCCOc1noc2c1CNCC2

InChI: InChI=1S/C10H16N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,2-7H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.60 QSARToolbox 1 » 0
7.60 OCHEM 1 » 0
7.60 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization