Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL207957

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
COc1ccc(-c2ccc(COc3ccc(OCC(=O)O)c(C)c3)cc2-c2ccc(OC)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL207957
Phase Preclinical
Structure Type MOL
InChI Key WEZWVTHGDNKJBD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

484.6
MW (Da)
6.39
ALogP
5
HBA
1
HBD
74.2
PSA (Ų)
0.28
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H28O6
MW 484.55
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.25

Literature References

PubMed DOI Target Context # Activities
16546385 10.1016/j.bmcl.2006.02.079 Peroxisome proliferator-activated receptor alpha 1
16546385 10.1016/j.bmcl.2006.02.079 Peroxisome proliferator-activated receptor gamma 1
16546385 10.1016/j.bmcl.2006.02.079 Peroxisome proliferator-activated receptor delta 1

Data from ChEMBL 36 via Core Engine