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Compound Detail

CHEMBL201524

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COc1c(Cc2cn(C(c3ccccc3)c3ccccc3)c3cc(Cl)ccc23)cccc1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL201524
Phase Preclinical
Structure Type MOL
InChI Key AYIXCLVKEOYYNB-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

482.0
MW (Da)
7.23
ALogP
3
HBA
1
HBD
51.5
PSA (Ų)
0.27
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 C30H24ClNO3
MW 481.98
Aromatic Rings 5
Heavy Atoms 35
NP-Likeness -0.31

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16392799 10.1021/jm0507882 Cytosolic phospholipase A2 1

Data from ChEMBL 36 via Core Engine