10967/149 - QDB Compounds

QsarDB Repository

Narasimhan, B.; Ansari, A.M.; Singh, N.; Mourya, V.; Dhakee, A.S. A QSAR Approach for the Prediction of Stability of Benzoglycolamide Ester Prodrugs. Chem. Pharm. Bull. 2006, 54, 1067–1071.

Compound

ID:34
Name:1-[2-(benzoyloxy)acetamido]azetidine-2-carboxylic acid
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C13H14N2O5/c16-11(14-15-7-6-10(15)12(17)18)8-20-13(19)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,16)(H,17,18)

Properties

logK: Hydrolytic rate constant as logK

ValueSource or prediction
-1.39

experimental value

-1.18

Tab4.model3: Model for benzoglycolamide ester prodrugs (Training set)