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:18
Name:[ethyl(2-hydroxyethyl)carbamoyl]methyl benzoate
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C13H17NO4/c1-2-14(8-9-15)12(16)10-18-13(17)11-6-4-3-5-7-11/h3-7,15H,2,8-10H2,1H3

Properties

logK: Hydrolytic rate constant as logK

ValueSource or prediction
-1.21

experimental value

-1.25

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