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

CHEMBL5289712

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
Fc1ccc([C@H]2c3ccccc3CCN2C2=N[C@@H](C3CN4CCC3CC4)CO2)cc1

Basic Information

ChEMBL ID CHEMBL5289712
Phase Preclinical
Structure Type MOL
InChI Key SMCCEKIOJYIRLQ-XQFMJXHWSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

405.5
MW (Da)
3.87
ALogP
4
HBA
0
HBD
28.1
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H28FN3O
MW 405.52
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.14

Activity Summary

EC50 1 meas. best 6.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
EC50 6.64 6.64 231.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked EC50 = 231.0 nM 6.64 Induction of progranulin secretion in mouse BV-2 cells 36368496

Literature References

PubMed DOI Target Context # Activities
36368496 10.1016/j.bmcl.2022.129048 Unchecked 1

Data from ChEMBL 36 via Core Engine