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

CHEMBL493571

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
Cc1cccc(NC(=O)c2ccc(C#N)cc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL493571
Phase Preclinical
Structure Type MOL
InChI Key AXSOUIICIQVSBZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

237.3
MW (Da)
2.51
ALogP
3
HBA
1
HBD
65.8
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11N3O
MW 237.26
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -2.14

Literature References

PubMed DOI Target Context # Activities
19445453 10.1021/jm900172f Metabotropic glutamate receptor 5 3
19445453 10.1021/jm900172f Metabotropic glutamate receptor 1 1
19445453 10.1021/jm900172f Metabotropic glutamate receptor 6 1

Data from ChEMBL 36 via Core Engine