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Compound Detail

CHEMBL2262157

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Cc1ccc(C(=O)/C=C/c2ccccc2F)o1

Basic Information

ChEMBL ID CHEMBL2262157
Phase Preclinical
Structure Type MOL
InChI Key RTSRDSWVEFGWAF-BQYQJAHWSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

230.2
MW (Da)
3.62
ALogP
2
HBA
0
HBD
30.2
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11FO2
MW 230.24
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.25

Activity Summary

IC50 2 meas. best 4.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
RAW264.7
CHEMBL612557
IC50 4.89 4.89 12870.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1007/s00044-011-9706-1 RAW264.7 2

Data from ChEMBL 36 via Core Engine