ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02635
Compound NameDiosgenin 3-O-alpha-L-rhamnopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->4))-(alpha-L-rhamnopyranosyl-(1->2))-beta-D-glucopyranoside
Chemical ClassOrganic Chemicals
Molecular Weight1015.197
logP-0.392
H-Bond Donor10.00
H-Bond Acceptor32
Caco-2 Permeability2.130
logSwat-5.821
Number of Primary Metabolites12
Polar Surface Area277.726
Rotatable Bonds19
logKhsa-1.280
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.567
Blood Brain Barrier (logBB)-5.887
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations3
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1438
NPACT   -
TaxKB   -
Structure Download

 






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