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Compound Detail

CHEMBL5412058

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CN(C(=O)Oc1cccc(-n2ccc(C(N)=O)c2)c1)C1CCN(CCc2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5412058
Phase Preclinical
Structure Type MOL
InChI Key RQCDUJKNJRGGQI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

446.6
MW (Da)
3.71
ALogP
5
HBA
1
HBD
80.8
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 C26H30N4O3
MW 446.55
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.34

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