ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00142
Compound Name8,10-diacetoxy-2-methoxy-3,11(13)-guai-adiene-12,6-olide
Chemical ClassUnknown
Molecular Weight378.421
logP1.805
H-Bond Donor0.00
H-Bond Acceptor9
Caco-2 Permeability926.385
logSwat-2.191
Number of Primary Metabolites4
Polar Surface Area102.849
Rotatable Bonds4
logKhsa-0.568
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.466
Blood Brain Barrier (logBB)-0.581
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0421
NPACT   -
TaxKB   -
Structure Download

 






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