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Compound Detail

CHEMBL479891

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CCCCCCC/C=C\[C@H](O)C#CC#CC(=O)CCOC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL479891
Phase Preclinical
Structure Type MOL
InChI Key FJWBUWYAOLZOKU-GKUQOKNUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

290.4
MW (Da)
2.88
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.29
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C18H26O3
MW 290.40
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness 2.13

Literature References

PubMed DOI Target Context # Activities
16643021 10.1021/np050301s 5-hydroxytryptamine receptor 7 2

Data from ChEMBL 36 via Core Engine