ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03943
Compound Namealpha-Tocospiro A
Chemical ClassBenzopyranoids
Molecular Weight462.712
logP7.175
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability1869.445
logSwat-8.758
Number of Primary Metabolites4
Polar Surface Area69.791
Rotatable Bonds14
logKhsa1.573
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.650
Blood Brain Barrier (logBB)-1.193
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol3653
NPACT   -
TaxKB   -
Structure Download

 






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