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

CHEMBL4472715

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
COC(=O)[C@@H](N)CSCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4472715
Phase Preclinical
Structure Type MOL
InChI Key DELQRANKBWOLJQ-JTQLQIEISA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

225.3
MW (Da)
1.42
ALogP
4
HBA
1
HBD
52.3
PSA (Ų)
0.77
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H15NO2S
MW 225.31
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -0.30

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
31255924 10.1016/j.ejmech.2019.06.059 Toll-like receptor 2 1

Data from ChEMBL 36 via Core Engine