ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04014
Compound Name2,4-Chebulyl-beta-D-glucopyranose
Chemical ClassTannin
Molecular Weight528.379
logP-3.802
H-Bond Donor7.00
H-Bond Acceptor21
Caco-2 Permeability0.052
logSwat-1.791
Number of Primary Metabolites8
Polar Surface Area301.283
Rotatable Bonds9
logKhsa-1.417
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-1.907
Blood Brain Barrier (logBB)-4.284
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00063
TaxKB   -
Structure Download

 






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