ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00237
Compound Namenagilactone D
Chemical ClassTerpenoids
Molecular Weight332.352
logP0.439
H-Bond Donor0.00
H-Bond Acceptor8
Caco-2 Permeability396.519
logSwat-1.175
Number of Primary Metabolites3
Polar Surface Area104.123
Rotatable Bonds2
logKhsa-0.932
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.966
Blood Brain Barrier (logBB)-0.723
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0561
NPACT   -
TaxKB   -
Structure Download

 






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