ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02208
Compound NameIsohelianol
Chemical ClassTerpenoids
Molecular Weight428.740
logP7.979
H-Bond Donor1.00
H-Bond Acceptor2
Caco-2 Permeability2884.143
logSwat-9.150
Number of Primary Metabolites8
Polar Surface Area23.159
Rotatable Bonds8
logKhsa2.220
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.840
Blood Brain Barrier (logBB)-0.507
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0897
NPACT   -
TaxKB   -
Structure Download

 






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