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Compound Detail

CHEMBL338630

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CCCCCCOC(=O)c1ccc2c(c1)-c1c(OC)cc(C(C)(C)CCCCCC)cc1OC2(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL338630
Phase Preclinical
Structure Type MOL
InChI Key LUKURKKDJASILX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

494.7
MW (Da)
8.97
ALogP
4
HBA
0
HBD
44.8
PSA (Ų)
0.21
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H46O4
MW 494.72
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness 0.53

Literature References

PubMed DOI Target Context # Activities
11020293 10.1021/jm0001572 Cannabinoid receptor 1 1
11020293 10.1021/jm0001572 Cannabinoid receptor 2 1
11020293 10.1021/jm0001572 Cannabinoid receptor 1

Data from ChEMBL 36 via Core Engine