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Compound Detail

CHEMBL270596

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O=C1NC(=S)NC(=O)C1=Cc1ccc(F)cc1

Basic Information

ChEMBL ID CHEMBL270596
Phase Preclinical
Structure Type MOL
InChI Key JHIXUZZXOFGDGE-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

250.2
MW (Da)
0.74
ALogP
3
HBA
2
HBD
58.2
PSA (Ų)
0.44
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H7FN2O2S
MW 250.25
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -1.30

Activity Summary

Ki 1 meas. best 5.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Methionine aminopeptidase 1
CHEMBL2474
Ki 5.22 5.22 6000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Methionine aminopeptidase 1 Ki = 6000.0 nM 5.22 Inhibition of human methionine aminopeptidase 1 18343108

Literature References

PubMed DOI Target Context # Activities
18343108 10.1016/j.bmcl.2008.02.066 Unchecked 1
18343108 10.1016/j.bmcl.2008.02.066 Methionine aminopeptidase 1 1

Data from ChEMBL 36 via Core Engine