ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00474
Compound Name8-Chlorogoniodiol
Chemical ClassOxygen heterocycles
Molecular Weight252.697
logP2.233
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability1119.543
logSwat-3.078
Number of Primary Metabolites4
Polar Surface Area60.624
Rotatable Bonds4
logKhsa-0.225
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.945
Blood Brain Barrier (logBB)-0.433
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1667
NPACT   -
TaxKB   -
Structure Download

 






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