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Compound Detail

CHEMBL5079558

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O=c1c2ccccc2[se]n1-c1ccc(-c2ccccc2)cc1

Basic Information

ChEMBL ID CHEMBL5079558
Phase Preclinical
Structure Type MOL
InChI Key TXDOEGXLLCYLPH-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

350.3
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H13NOSe
MW 350.28

Activity Summary

IC50 1 meas. best 7.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 7.22 7.22 60.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 60.0 nM 7.22 Inhibition of wild type Candida albicans Fructose-1,6-Bisphosphate Aldolase tran... 35099959

Literature References

PubMed DOI Target Context # Activities
38903944 10.1039/d4md00031e Escherichia coli 6
35099959 10.1021/acs.jmedchem.1c02102 Candida albicans 4
35099959 10.1021/acs.jmedchem.1c02102 Unchecked 1

Data from ChEMBL 36 via Core Engine