ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01802
Compound Name11-hydroxy-14,15alpha-epoxytabersonine
Chemical ClassAlkaloids
Molecular Weight368.432
logP2.506
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability195.241
logSwat-3.137
Number of Primary Metabolites2
Polar Surface Area82.568
Rotatable Bonds3
logKhsa0.344
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines1
Number of Acids0
loghERG-4.802
Blood Brain Barrier (logBB)-0.230
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0181
NPACT   -
TaxKB   -
Structure Download

 






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