ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04100
Compound Name6'-desmethylthalifaboramine
Chemical ClassAlkaloids
Molecular Weight638.759
logP5.781
H-Bond Donor2.00
H-Bond Acceptor9
Caco-2 Permeability62.696
logSwat-6.433
Number of Primary Metabolites14
Polar Surface Area89.156
Rotatable Bonds10
logKhsa1.512
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines2
Number of Acids0
loghERG-7.829
Blood Brain Barrier (logBB)-0.446
CNS Permeability1
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00186
TaxKB   -
Structure Download

 






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