ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03474
Compound NameEsulatin I
Chemical ClassTerpenoids
Molecular Weight654.710
logP4.032
H-Bond Donor0.00
H-Bond Acceptor14
Caco-2 Permeability508.880
logSwat-4.636
Number of Primary Metabolites4
Polar Surface Area195.176
Rotatable Bonds6
logKhsa0.088
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.018
Blood Brain Barrier (logBB)-1.096
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations0
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2761
NPACT   -
TaxKB   -
Structure Download

 






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