ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04166
Compound NameAnnoreticuin-9-one
Chemical ClassPolyketides
Molecular Weight594.871
logP6.490
H-Bond Donor3.00
H-Bond Acceptor12
Caco-2 Permeability133.299
logSwat-8.968
Number of Primary Metabolites8
Polar Surface Area135.131
Rotatable Bonds29
logKhsa0.821
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.007
Blood Brain Barrier (logBB)-4.106
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00267
TaxKB   -
Structure Download

 






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