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Compound Detail

CHEMBL523856

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Cc1cccc(NC(=O)c2cncc(-c3cccnc3)c2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL523856
Phase Preclinical
Structure Type MOL
InChI Key DNLKIKCYGZIASH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

290.3
MW (Da)
3.10
ALogP
4
HBA
1
HBD
67.8
PSA (Ų)
0.80
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 C17H14N4O
MW 290.33
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.83

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