ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04662
Compound NameSquamocin-D
Chemical ClassPolyketides
Molecular Weight622.924
logP7.512
H-Bond Donor3.00
H-Bond Acceptor12
Caco-2 Permeability360.106
logSwat-10.398
Number of Primary Metabolites7
Polar Surface Area117.371
Rotatable Bonds27
logKhsa1.208
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.195
Blood Brain Barrier (logBB)-3.390
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00956
TaxKB   -
Structure Download

 






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