ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02181
Compound NameThalicoside A
Chemical ClassTerpenoids
Molecular Weight799.007
logP0.352
H-Bond Donor10.00
H-Bond Acceptor24
Caco-2 Permeability5.966
logSwat-4.300
Number of Primary Metabolites13
Polar Surface Area237.754
Rotatable Bonds21
logKhsa-0.902
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.619
Blood Brain Barrier (logBB)-4.720
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol0868
NPACT   -
TaxKB   -
Structure Download

 






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