ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02791
Compound NameMontalicin J
Chemical ClassOxygen heterocycles
Molecular Weight624.940
logP7.177
H-Bond Donor4.00
H-Bond Acceptor12
Caco-2 Permeability154.534
logSwat-9.479
Number of Primary Metabolites7
Polar Surface Area127.658
Rotatable Bonds32
logKhsa0.973
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.141
Blood Brain Barrier (logBB)-4.265
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1620
NPACT   -
TaxKB   -
Structure Download

 






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