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Compound Detail

CHEMBL2377415

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COc1ccc(C(=O)CCC2COc3cccc(OCC4CCCCC4)c3C2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2377415
Phase Preclinical
Structure Type MOL
InChI Key GJXSGFBWHNULLU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

422.5
MW (Da)
5.51
ALogP
5
HBA
0
HBD
61.8
PSA (Ų)
0.53
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H30O5
MW 422.52
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness 0.12

Literature References

PubMed DOI Target Context # Activities
23523388 10.1016/j.bmc.2013.02.037 Interleukin-5 2

Data from ChEMBL 36 via Core Engine