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Compound Detail

CHEMBL1688758

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CCC(Oc1ccc2c(c1)B(O)OC2)C(C)=O

Basic Information

ChEMBL ID CHEMBL1688758
Phase Preclinical
Structure Type MOL
InChI Key XFHNVBGFUAYSEH-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

234.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H15BO4
MW 234.06

Activity Summary

IC50 2 meas. best 5.46

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.46 5.46 3500.0 1
Trypanosoma brucei brucei
CHEMBL612851
IC50 5.42 5.42 3760.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21322634 10.1021/jm101225g Unchecked 1
21322634 10.1021/jm101225g Trypanosoma brucei brucei 1
21322634 10.1021/jm101225g L929 1

Data from ChEMBL 36 via Core Engine