ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03086
Compound NameMethyl rocaglate
Chemical ClassBenzofuranoids
Molecular Weight492.524
logP5.138
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability827.075
logSwat-6.835
Number of Primary Metabolites8
Polar Surface Area101.831
Rotatable Bonds6
logKhsa0.981
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.128
Blood Brain Barrier (logBB)-0.977
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2115
NPACT   -
TaxKB   -
Structure Download

 






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