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Compound Detail

CHEMBL159221

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CC/C=C/C/C=C\C/C=C\CCCCCCCCCC(=O)NCCO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL159221
Phase Preclinical
Structure Type MOL
InChI Key IGERBKTWMBMXMC-NSAMXNATSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

349.6
MW (Da)
5.46
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.27
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H39NO2
MW 349.56
Aromatic Rings 0
Heavy Atoms 25
NP-Likeness 0.74

Literature References

PubMed DOI Target Context # Activities
9057852 10.1021/jm960752x Cannabinoid receptor 1 1

Data from ChEMBL 36 via Core Engine