Molecule ID: mol2434

SMILES: CC(C)N1CCCC(=O)[C@H](O)CCC1

InChI: InChI=1S/C11H21NO2/c1-9(2)12-7-3-5-10(13)11(14)6-4-8-12/h9-10,13H,3-8H2,1-2H3/t10-/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization