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

CHEMBL4783963

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
CCc1cc(F)c([C@@H]2CNC(=O)[C@H]2NC(=O)Nc2ccc(F)cc2)c(F)c1

Basic Information

ChEMBL ID CHEMBL4783963
Phase Preclinical
Structure Type MOL
InChI Key GHWMVXHLEAWLMB-GUYCJALGSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
3.07
ALogP
2
HBA
3
HBD
70.2
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H18F3N3O2
MW 377.37
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.93

Activity Summary

EC50 2 meas. best 8.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
N-formyl peptide receptor 2
CHEMBL4227
EC50 8.24 8.24 5.8 1
fMet-Leu-Phe receptor
CHEMBL3359
EC50 5.82 5.82 1500.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
32407089 10.1021/acs.jmedchem.9b02101 N-formyl peptide receptor 2 1
32407089 10.1021/acs.jmedchem.9b02101 fMet-Leu-Phe receptor 1
32407089 10.1021/acs.jmedchem.9b02101 Unchecked 1

Data from ChEMBL 36 via Core Engine