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Compound Detail

CHEMBL5427155

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NC(=O)c1ccn(-c2cccc(OC(=O)NC3CCN(CCc4ccccc4)CC3)c2)c1

Basic Information

ChEMBL ID CHEMBL5427155
Phase Preclinical
Structure Type MOL
InChI Key GRJPWTPFVYLOPA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
3.37
ALogP
5
HBA
2
HBD
89.6
PSA (Ų)
0.60
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H28N4O3
MW 432.52
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.39

Activity Summary

IC50 1 meas. best 6.5

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fatty-acid amide hydrolase 1
CHEMBL2243
IC50 6.5 6.5 315.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36462439 10.1016/j.ejmech.2022.114952 Fatty-acid amide hydrolase 1 1
36462439 10.1016/j.ejmech.2022.114952 Monoglyceride lipase 1

Data from ChEMBL 36 via Core Engine