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Compound Detail

CHEMBL2347084

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O=C1Nc2ccc(F)cc2/C1=C/c1ccc(-c2cccc(Br)c2)o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2347084
Phase Preclinical
Structure Type MOL
InChI Key PGTPMGUXFZYVGR-YBEGLDIGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

384.2
MW (Da)
5.34
ALogP
2
HBA
1
HBD
42.2
PSA (Ų)
0.61
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H11BrFNO2
MW 384.20
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.19

Literature References

PubMed DOI Target Context # Activities
23434140 10.1016/j.bmc.2013.01.047 Ribosomal protein S6 kinase alpha-3 2

Data from ChEMBL 36 via Core Engine