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

CHEMBL192292

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
O=C(/C=C/c1ccc(Br)cc1)Nc1ccc2c(c1)OCCO2

Basic Information

ChEMBL ID CHEMBL192292
Phase Preclinical
Structure Type MOL
InChI Key WIVDKVOYPFHMLG-FPYGCLRLSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

360.2
MW (Da)
3.87
ALogP
3
HBA
1
HBD
47.6
PSA (Ų)
0.85
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 C17H14BrNO3
MW 360.21
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.98

Activity Summary

IC50 4 meas. best 6.96

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Transient receptor potential cation channel subfamily V member 1
CHEMBL4794
IC50 6.96 6.695 110.0 2
Unchecked
CHEMBL612545
IC50 6.47 6.47 338.8 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
15634002 10.1021/jm049485i Transient receptor potential cation channel subfamily V member 1 2
17948977 10.1021/jm070261k Unchecked 2

Data from ChEMBL 36 via Core Engine