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Compound Detail

CHEMBL566318

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Cc1c(-c2ccccc2)sc(N)c1C(=O)c1ccccc1

Basic Information

ChEMBL ID CHEMBL566318
Phase Preclinical
Structure Type MOL
InChI Key DUMIHKYUAPGCHM-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

293.4
MW (Da)
4.54
ALogP
3
HBA
1
HBD
43.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15NOS
MW 293.39
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.56

Activity Summary

IC50 1 meas. best 4.97

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Metabotropic glutamate receptor 6
CHEMBL4573
IC50 4.97 4.97 10600.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
19819046 10.1016/j.ejmech.2009.09.025 Metabotropic glutamate receptor 5 1
19819046 10.1016/j.ejmech.2009.09.025 Metabotropic glutamate receptor 6 1

Data from ChEMBL 36 via Core Engine