ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03716
Compound Namebenzoylgomisin Q
Chemical ClassLignans
Molecular Weight552.620
logP5.791
H-Bond Donor1.00
H-Bond Acceptor7
Caco-2 Permeability4198.358
logSwat-5.201
Number of Primary Metabolites9
Polar Surface Area87.835
Rotatable Bonds9
logKhsa0.991
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.966
Blood Brain Barrier (logBB)-0.308
CNS Permeability0
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3190
NPACT   -
TaxKB   -
Structure Download

 






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