ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02986
Compound NameOhioensin E
Chemical ClassOxygen heterocycles
Molecular Weight416.429
logP4.226
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability871.238
logSwat-5.629
Number of Primary Metabolites9
Polar Surface Area85.408
Rotatable Bonds4
logKhsa0.725
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.482
Blood Brain Barrier (logBB)-0.740
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1908
NPACT   -
TaxKB   -
Structure Download

 






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