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Compound Detail

CHEMBL2377408

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CC(C)(C)c1ccc(C(O)CCc2coc3cccc(OCC4CCCCC4)c3c2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2377408
Phase Preclinical
Structure Type MOL
InChI Key WRHSLYSXZKKWFF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

448.6
MW (Da)
6.72
ALogP
4
HBA
1
HBD
59.7
PSA (Ų)
0.44
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H36O4
MW 448.60
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness 0.02

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