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

CHEMBL1682908

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
Cc1cccc(C(=O)c2nc(C(=O)O)cc3c2[nH]c2ccccc23)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1682908
Phase Preclinical
Structure Type MOL
InChI Key HUHYWTKTCZUQLF-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

330.3
MW (Da)
3.95
ALogP
3
HBA
2
HBD
83.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H14N2O3
MW 330.34
Aromatic Rings 4
Heavy Atoms 25

Activity Summary

EC50 1 meas. best 6.33

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
NON-PROTEIN TARGET
CHEMBL3879801
 EC50 6.33 6.33 470.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
NON-PROTEIN TARGET EC50 = 470.0 nM 6.33 Antiinflammatory activity against mouse RAW246.7 cells assessed as inhibition of... 21316977

Literature References

PubMed DOI Target Context # Activities
21316977 10.1016/j.bmc.2011.01.034 RAW264.7 3
21316977 10.1016/j.bmc.2011.01.034 NON-PROTEIN TARGET 2
21316977 10.1016/j.bmc.2011.01.034 Radical scavenging activity 1
21316977 10.1016/j.bmc.2011.01.034 ADMET 1

Data from ChEMBL 36 via Core Engine