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Compound Detail

CHEMBL2377416

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O=C(CCC1COc2cccc(OCC3CCCCC3)c2C1=O)c1ccc(Cl)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2377416
Phase Preclinical
Structure Type MOL
InChI Key AFKONASAGJBTMM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

461.4
MW (Da)
6.81
ALogP
4
HBA
0
HBD
52.6
PSA (Ų)
0.43
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 C25H26Cl2O4
MW 461.39
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.17

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