ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02623
Compound Name(25R)-3beta-((O-alpha-L-Arabinopyranosyl-(1->3)-beta-D-glucopyranosyl-(1->2)-O-(beta-D-xylopyranosyl-(1->3))-O-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranosyl)oxy)-5alpha-spirostan-12-one
Chemical ClassUnknown
Molecular Weight1181.284
logP-4.891
H-Bond Donor14.00
H-Bond Acceptor44
Caco-2 Permeability0.255
logSwat-0.905
Number of Primary Metabolites15
Polar Surface Area400.384
Rotatable Bonds27
logKhsa-2.977
Number of Reactive Functional Groups6
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.723
Blood Brain Barrier (logBB)-6.940
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1426
NPACT   -
TaxKB   -
Structure Download

 






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