ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01136
Compound NameEnt-7-alpha-Acetoxy-14-beta-hydroxykaur-16-en-15-one
Chemical ClassTerpenoids
Molecular Weight360.492
logP3.492
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability1299.669
logSwat-4.581
Number of Primary Metabolites2
Polar Surface Area74.055
Rotatable Bonds3
logKhsa0.515
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.486
Blood Brain Barrier (logBB)-0.404
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00529
TaxKB   -
Structure Download

 






Copyright © 2018. Subhash M. Agarwal. All Rights Reserved.