Molecule ID: mol32304

SMILES: CCCN(CCC)CCCNC(=O)C=NO

InChI: InChI=1S/C11H23N3O2/c1-3-7-14(8-4-2)9-5-6-12-11(15)10-13-16/h10,16H,3-9H2,1-2H3,(H,12,15)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.73 OCHEM 1 » 0
8.73 QSARToolbox 1 » 0
10.35 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization