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Compound Detail

CHEMBL281783

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COc1cccc(CCB(O)O)c1

Basic Information

ChEMBL ID CHEMBL281783
Phase Preclinical
Structure Type MOL
InChI Key SCTAGQZQNPVBJV-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

180.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H13BO3
MW 180.01

Activity Summary

Ki 1 meas. best 4.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Beta-lactamase TEM
CHEMBL2065
Ki 4.3 4.3 50000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Beta-lactamase TEM Ki = 50000.0 nM 4.3 Inhibitory constant was determined against class A RTEM-1 Beta-lactamase from Es... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80336-X Beta-lactamase TEM 1

Data from ChEMBL 36 via Core Engine