ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04682
Compound NameToosendanin
Chemical ClassTerpenoids
Molecular Weight574.624
logP1.355
H-Bond Donor3.00
H-Bond Acceptor15
Caco-2 Permeability302.722
logSwat-3.406
Number of Primary Metabolites6
Polar Surface Area166.071
Rotatable Bonds5
logKhsa-0.289
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.827
Blood Brain Barrier (logBB)-1.090
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations0
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00983
TaxKB   -
Structure Download

 






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