ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00081
Compound Namesobrerol
Chemical ClassTerpenoids
Molecular Weight170.251
logP1.788
H-Bond Donor2.00
H-Bond Acceptor2
Caco-2 Permeability1970.917
logSwat-2.182
Number of Primary Metabolites4
Polar Surface Area40.457
Rotatable Bonds3
logKhsa-0.215
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.087
Blood Brain Barrier (logBB)-0.207
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0305
NPACT   -
TaxKB   -
Structure Download

 






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