ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02650
Compound NameIsonarthogenin-3-O-alpha-L-rhamnopyrano-syl-(1->2)-O-(alpha-L-rhamnopyranosyl-(1->4))-beta-D-glucopyranoside
Chemical ClassSaponin
Molecular Weight885.054
logP-0.033
H-Bond Donor9.00
H-Bond Acceptor27
Caco-2 Permeability3.176
logSwat-5.166
Number of Primary Metabolites11
Polar Surface Area239.350
Rotatable Bonds17
logKhsa-0.914
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.880
Blood Brain Barrier (logBB)-5.002
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1453
NPACT   -
TaxKB   -
Structure Download

 






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