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Compound Detail

CHEMBL498324

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CCn1c2ccccc2c2cc(NC(=O)CCc3cc(-c4ccccc4F)[nH]n3)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL498324
Phase Preclinical
Structure Type MOL
InChI Key AINAOCGEWHJMQA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

426.5
MW (Da)
5.91
ALogP
3
HBA
2
HBD
62.7
PSA (Ų)
0.35
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23FN4O
MW 426.50
Aromatic Rings 5
Heavy Atoms 32
NP-Likeness -1.70

Literature References

PubMed DOI Target Context # Activities
18680277 10.1021/jm800463f Cannabinoid receptor 1 4
18680277 10.1021/jm800463f Cannabinoid receptor 2 4

Data from ChEMBL 36 via Core Engine