ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04541
Compound NameMethyl linoleate
Chemical ClassAliphatic natural products
Molecular Weight294.476
logP5.969
H-Bond Donor0.00
H-Bond Acceptor2
Caco-2 Permeability1937.654
logSwat-6.574
Number of Primary Metabolites4
Polar Surface Area38.803
Rotatable Bonds14
logKhsa1.103
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.337
Blood Brain Barrier (logBB)-1.109
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00773
TaxKB   -
Structure Download

 






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