ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03014
Compound NameDeoxymorellin
Chemical ClassSimple aromatic natural products
Molecular Weight530.660
logP5.731
H-Bond Donor0.00
H-Bond Acceptor6
Caco-2 Permeability897.845
logSwat-6.194
Number of Primary Metabolites9
Polar Surface Area84.000
Rotatable Bonds5
logKhsa1.257
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.975
Blood Brain Barrier (logBB)-0.695
CNS Permeability0
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1953
NPACT   -
TaxKB   -
Structure Download

 






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