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Compound Detail

CHEMBL231989

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Cc1ccc2ccc(-c3cccc(C(N)=O)c3)cc2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL231989
Phase Preclinical
Structure Type MOL
InChI Key SYZQSPBOLXSDGY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

262.3
MW (Da)
3.31
ALogP
2
HBA
1
HBD
56.0
PSA (Ų)
0.77
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 C17H14N2O
MW 262.31
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.11

Literature References

PubMed DOI Target Context # Activities
17590335 10.1016/j.bmcl.2007.06.030 Metabotropic glutamate receptor 5 1

Data from ChEMBL 36 via Core Engine