Molecule ID: mol32568

SMILES: CN(C)CCCCCNC(=O)C=NO

InChI: InChI=1S/C9H19N3O2/c1-12(2)7-5-3-4-6-10-9(13)8-11-14/h8,14H,3-7H2,1-2H3,(H,10,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization