ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02670
Compound Name22-O-Methylprotodioscin
Chemical ClassSaponin
Molecular Weight1063.238
logP-1.822
H-Bond Donor12.00
H-Bond Acceptor36
Caco-2 Permeability0.336
logSwat-3.914
Number of Primary Metabolites14
Polar Surface Area321.191
Rotatable Bonds27
logKhsa-1.953
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.506
Blood Brain Barrier (logBB)-7.465
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1476
NPACT   -
TaxKB   -
Structure Download

 






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