ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01836
Compound Namepretazettine
Chemical ClassAlkaloids
Molecular Weight331.368
logP1.007
H-Bond Donor1.00
H-Bond Acceptor9
Caco-2 Permeability968.077
logSwat-1.091
Number of Primary Metabolites2
Polar Surface Area60.559
Rotatable Bonds2
logKhsa-0.483
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines1
Number of Acids0
loghERG-4.163
Blood Brain Barrier (logBB)0.499
CNS Permeability2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0221
NPACT   -
TaxKB   -
Structure Download

 






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