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:25
Name:[(pyrrolidin-1-yl)carbamoyl]methyl benzoate
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C13H16N2O3/c16-12(14-15-8-4-5-9-15)10-18-13(17)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,14,16)

Properties

logK: Hydrolytic rate constant as logK

ValueSource or prediction
-1.24

experimental value

-1.35

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