ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04727
Compound Name(7R,8S,7'R,8'R)-(+)-7'-acetylpicropodophyllin
Chemical ClassLignans
Molecular Weight456.448
logP2.807
H-Bond Donor0.00
H-Bond Acceptor9
Caco-2 Permeability1834.179
logSwat-3.453
Number of Primary Metabolites6
Polar Surface Area113.823
Rotatable Bonds4
logKhsa-0.235
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.193
Blood Brain Barrier (logBB)-0.378
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01050
TaxKB   -
Structure Download

 






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