ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03916
Compound Nametrans-N-feruloyloctopamine
Chemical ClassOrganic Chemicals
Molecular Weight329.352
logP2.225
H-Bond Donor4.00
H-Bond Acceptor6
Caco-2 Permeability132.704
logSwat-3.569
Number of Primary Metabolites4
Polar Surface Area110.135
Rotatable Bonds10
logKhsa-0.249
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.856
Blood Brain Barrier (logBB)-2.049
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3615
NPACT   -
TaxKB   -
Structure Download

 






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