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:15
Name:[bis(2-methylpropyl)carbamoyl]methyl benzoate
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C17H25NO3/c1-13(2)10-18(11-14(3)4)16(19)12-21-17(20)15-8-6-5-7-9-15/h5-9,13-14H,10-12H2,1-4H3

Properties

logK: Hydrolytic rate constant as logK

ValueSource or prediction
-1.01

experimental value

-0.97

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