ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID05011
Compound Nameneoannonin
Chemical ClassPolyketides
Molecular Weight578.871
logP7.725
H-Bond Donor2.00
H-Bond Acceptor10
Caco-2 Permeability565.606
logSwat-10.410
Number of Primary Metabolites6
Polar Surface Area97.566
Rotatable Bonds24
logKhsa1.407
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.011
Blood Brain Barrier (logBB)-2.823
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT01470
TaxKB   -
Structure Download

 






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