Molecule ID: mol29619

SMILES: CCCCCCCC1(C)NNC(=O)NC1=O

InChI: InChI=1S/C11H21N3O2/c1-3-4-5-6-7-8-11(2)9(15)12-10(16)13-14-11/h14H,3-8H2,1-2H3,(H2,12,13,15,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization