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Compound Detail

CHEMBL189920

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CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCC(C)C(=O)OCC(O)CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL189920
Phase Preclinical
Structure Type MOL
InChI Key RNRHZGNDJIHLCX-ZKWNWVNESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

392.6
MW (Da)
5.27
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.20
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 C24H40O4
MW 392.58
Aromatic Rings 0
Heavy Atoms 28
NP-Likeness 1.44

Literature References

PubMed DOI Target Context # Activities
16078824 10.1021/jm058183t Fatty-acid amide hydrolase 1 1
16078824 10.1021/jm058183t Monoglyceride lipase 1

Data from ChEMBL 36 via Core Engine