ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01714
Compound Namecassyfiline
Chemical ClassAlkaloids
Molecular Weight341.363
logP2.318
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability471.497
logSwat-2.828
Number of Primary Metabolites6
Polar Surface Area67.164
Rotatable Bonds3
logKhsa0.201
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines1
Number of Acids0
loghERG-4.811
Blood Brain Barrier (logBB)0.113
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0035
NPACT   -
TaxKB   -
Structure Download

 






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