ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02091
Compound Namepseudolaric acid B-O-betaD-glucopyra-noside
Chemical ClassTerpenoids
Molecular Weight594.611
logP0.224
H-Bond Donor4.00
H-Bond Acceptor18
Caco-2 Permeability6.382
logSwat-4.580
Number of Primary Metabolites7
Polar Surface Area224.982
Rotatable Bonds12
logKhsa-0.641
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.477
Blood Brain Barrier (logBB)-4.003
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol0762
NPACT   -
TaxKB   -
Structure Download

 






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