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

CHEMBL492377

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=c1cccc(C2=NC(c3ccc(F)cc3)(c3ccc(F)cc3)CN2)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL492377
Phase Preclinical
Structure Type MOL
InChI Key WXNATCXWMXDARJ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

351.4
MW (Da)
2.95
ALogP
3
HBA
2
HBD
57.2
PSA (Ų)
0.76
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 C20H15F2N3O
MW 351.36
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.17

Activity Summary

IC50 1 meas. best 8.09

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Neuropeptide Y receptor type 5
CHEMBL4561
 IC50 8.09 8.09 8.1 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Neuropeptide Y receptor type 5 IC50 = 8.1 nM 8.09 Displacement of [125I]PYY from human recombinant neuropeptide Y5 receptor expres... 19233647

Literature References

PubMed DOI Target Context # Activities
19233647 10.1016/j.bmcl.2009.01.101 Neuropeptide Y receptor type 5 1

Data from ChEMBL 36 via Core Engine