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:29
Name:[(2-ethylpiperidin-1-yl)carbamoyl]methyl benzoate
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C16H22N2O3/c1-2-14-10-6-7-11-18(14)17-15(19)12-21-16(20)13-8-4-3-5-9-13/h3-5,8-9,14H,2,6-7,10-12H2,1H3,(H,17,19)

Properties

logK: Hydrolytic rate constant as logK

ValueSource or prediction
-1.08

experimental value

-1.11

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