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Compound Detail

CHEMBL5428771

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Cc1c(-c2ccc(F)cc2)c2cc(F)ccc2n1CC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5428771
Phase Preclinical
Structure Type MOL
InChI Key OWJBVYXOBHRQBI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

301.3
MW (Da)
3.98
ALogP
2
HBA
1
HBD
42.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13F2NO2
MW 301.29
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.03

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