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Compound Detail

CHEMBL5177779

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O=C(c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)nc1)N1CCN(Cc2c(F)cc(Br)cc2F)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5177779
Phase Preclinical
Structure Type MOL
InChI Key SNHZDPJAFKHXIO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

608.4
MW (Da)
5.82
ALogP
6
HBA
0
HBD
75.4
PSA (Ų)
0.27
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H19BrF5N5O2
MW 608.37
Aromatic Rings 4
Heavy Atoms 39
NP-Likeness -1.90

Literature References

PubMed DOI Target Context # Activities
36103247 10.1021/acs.jmedchem.2c00413 Signal transducer and activator of transcription 3 1

Data from ChEMBL 36 via Core Engine