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Compound Detail

CHEMBL381066

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Cc1cc(OCc2ccc(-c3ccc(OC(F)(F)F)cc3)c(-c3ccc(OC(F)(F)F)cc3)c2)ccc1OCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL381066
Phase Preclinical
Structure Type MOL
InChI Key WXVKNMWJOXNNFD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

592.5
MW (Da)
8.17
ALogP
5
HBA
1
HBD
74.2
PSA (Ų)
0.19
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H22F6O6
MW 592.49
Aromatic Rings 4
Heavy Atoms 42
NP-Likeness -0.41

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