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Compound Detail

CHEMBL205958

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CCCCC/C=C\C/C=C\C/C=C\C/C=C\CC[C@H](C)C(=O)OC(CF)CF
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL205958
Phase Preclinical
Structure Type MOL
InChI Key PETXVIUBNRQRDS-AQNSPSBUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

396.6
MW (Da)
7.23
ALogP
2
HBA
0
HBD
26.3
PSA (Ų)
0.15
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 C24H38F2O2
MW 396.56
Aromatic Rings 0
Heavy Atoms 28
NP-Likeness 1.15

Literature References

PubMed DOI Target Context # Activities
16466915 10.1016/j.bmcl.2006.01.101 Cannabinoid receptor 1 2

Data from ChEMBL 36 via Core Engine