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

CHEMBL497285

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
CCCCCCCCCCCCC(=O)/C=C/c1ccc(O)c(O)c1

Basic Information

ChEMBL ID CHEMBL497285
Phase Preclinical
Structure Type MOL
InChI Key MUCVVLXZWIGJKM-FYWRMAATSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

332.5
MW (Da)
5.99
ALogP
3
HBA
2
HBD
57.5
PSA (Ų)
0.26
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H32O3
MW 332.48
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness 0.96

Activity Summary

EC50 2 meas. best 7.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
RAW264.7
CHEMBL612557
EC50 7.22 6.525 60.8 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
18667320 10.1016/j.bmc.2008.07.006 RAW264.7 2

Data from ChEMBL 36 via Core Engine