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Compound Detail

CHEMBL4174583

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O=C1c2c(O)cccc2CC1Cc1ccc(Cl)cc1

Basic Information

ChEMBL ID CHEMBL4174583
Phase Preclinical
Structure Type MOL
InChI Key BWXOUWSKZUKGSA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

272.7
MW (Da)
3.64
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.91
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H13ClO2
MW 272.73
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness 0.76

Literature References

PubMed DOI Target Context # Activities
29689475 10.1016/j.ejmech.2018.04.030 Interleukin-5 2

Data from ChEMBL 36 via Core Engine