ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04007
Compound Name1-cinnamoyl-3-acetyl-11-methoxymeliacarpinin
Chemical ClassTerpenoids
Molecular Weight738.784
logP4.293
H-Bond Donor2.00
H-Bond Acceptor15
Caco-2 Permeability662.593
logSwat-5.464
Number of Primary Metabolites4
Polar Surface Area170.863
Rotatable Bonds9
logKhsa0.397
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.646
Blood Brain Barrier (logBB)-1.188
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations0
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00054
TaxKB   -
Structure Download

 






Copyright © 2018. Subhash M. Agarwal. All Rights Reserved.