ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03589
Compound NameN-phenethylcrinasiadine
Chemical ClassAlkaloids
Molecular Weight343.381
logP4.084
H-Bond Donor0.00
H-Bond Acceptor5
Caco-2 Permeability4488.807
logSwat-4.272
Number of Primary Metabolites1
Polar Surface Area47.137
Rotatable Bonds3
logKhsa0.288
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.784
Blood Brain Barrier (logBB)0.056
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2951
NPACT   -
TaxKB   -
Structure Download

 






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