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Compound Detail

CHEMBL158880

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CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCN(CC)CC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL158880
Phase Preclinical
Structure Type MOL
InChI Key LOZCJJDEBAPQGP-AILJCPQKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

402.7
MW (Da)
6.59
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.20
QED
1
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H46N2O
MW 402.67
Aromatic Rings 0
Heavy Atoms 29

Literature References

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

Data from ChEMBL 36 via Core Engine