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

CHEMBL4300174

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
Fc1ccc2c(c1)[I+]c1ccccc1-2

Basic Information

ChEMBL ID CHEMBL4300174
Phase Preclinical
Structure Type MOL
InChI Key YOINSLVIAOMBRI-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

297.1
MW (Da)
-0.07
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H7FI+
MW 297.09
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.70

Activity Summary

EC50 1 meas. best 5.88

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
G-protein coupled receptor 3
CHEMBL4523856
EC50 5.88 5.88 1310.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
37541631 10.1016/j.bmcl.2023.129427 G-protein coupled receptor 3 2

Data from ChEMBL 36 via Core Engine