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Compound Detail

CHEMBL520514

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Cc1c(O)c(C(=O)Cc2ccccc2)c(O)c(C(=O)Cc2ccccc2)c1O

Basic Information

ChEMBL ID CHEMBL520514
Phase Preclinical
Structure Type MOL
InChI Key BFDSXZBKXYAVJO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

376.4
MW (Da)
3.96
ALogP
5
HBA
3
HBD
94.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H20O5
MW 376.41
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness 0.40

Literature References

PubMed DOI Target Context # Activities
18818074 10.1016/j.bmcl.2008.09.041 Phospholipase A2, membrane associated 3
18818074 10.1016/j.bmcl.2008.09.041 Phospholipase A2 group V 2
18818074 10.1016/j.bmcl.2008.09.041 Group 10 secretory phospholipase A2 2

Data from ChEMBL 36 via Core Engine