ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00771
Compound Name4-O-beta-d-galactopyranosyl-3-hydroxyl-phenylethene
Chemical ClassSaponin
Molecular Weight298.292
logP-0.547
H-Bond Donor5.00
H-Bond Acceptor10
Caco-2 Permeability82.238
logSwat-1.890
Number of Primary Metabolites5
Polar Surface Area124.066
Rotatable Bonds9
logKhsa-0.879
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.632
Blood Brain Barrier (logBB)-2.003
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2475
NPACT   -
TaxKB   -
Structure Download

 






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