ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01755
Compound Nameanticancer alkaloid PMV70P691-051
Chemical ClassAlkaloids
Molecular Weight234.257
logP2.521
H-Bond Donor2.00
H-Bond Acceptor3
Caco-2 Permeability1389.597
logSwat-3.641
Number of Primary Metabolites3
Polar Surface Area55.805
Rotatable Bonds0
logKhsa0.103
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.209
Blood Brain Barrier (logBB)-0.210
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0109
NPACT   -
TaxKB   -
Structure Download

 






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