ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02633
Compound Name(25R)-2alpha,17alpha-Dihydroxyspirost-5-en-3beta-yl O-beta-D-glucopyranosyl-(1->2)-O-(beta-D-xylo-pyranosyl-(1->3))-O-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside
Chemical ClassUnknown
Molecular Weight1065.168
logP-3.627
H-Bond Donor14.00
H-Bond Acceptor38
Caco-2 Permeability0.306
logSwat-2.894
Number of Primary Metabolites16
Polar Surface Area361.202
Rotatable Bonds25
logKhsa-2.478
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.387
Blood Brain Barrier (logBB)-7.264
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1436
NPACT   -
TaxKB   -
Structure Download

 






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