Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5085736

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCCCCCCn1[se]c2ccccc2c1=O

Basic Information

ChEMBL ID CHEMBL5085736
Phase Preclinical
Structure Type MOL
InChI Key CLVCKKVNAZXPRI-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

310.3
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H21NOSe
MW 310.30

Activity Summary

IC50 1 meas. best 5.57

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.57 5.57 2690.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 2690.0 nM 5.57 Inhibition of GST-tagged SARS-CoV-2 main protease expressed in Escherichia coli ... 34570513

Literature References

PubMed DOI Target Context # Activities
34570513 10.1021/acs.jmedchem.1c00566 Unchecked 1
34570513 10.1021/acs.jmedchem.1c00566 SARS-CoV-2 1

Data from ChEMBL 36 via Core Engine