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Compound Detail

CHEMBL5428075

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O=C(O)c1c[nH]c(=O)n(-c2ccccc2)c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5428075
Phase Preclinical
Structure Type MOL
InChI Key XPJCKTHELWCTTN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

232.2
MW (Da)
0.22
ALogP
4
HBA
2
HBD
92.2
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H8N2O4
MW 232.19
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.85

Literature References

PubMed DOI Target Context # Activities
37256819 10.1021/acs.jmedchem.3c00485 Nuclear receptor subfamily 4 group A member 2 3

Data from ChEMBL 36 via Core Engine