GPCRdb

CHEMBL4063837

Agent/drug
Bioactivity

CHEMBL4063837

SMILES	CC(C)(C)C[C@@H]1COCc2nc(OCc3ccccn3)cc(=O)n21
InChIKey	QDIYOEYPJWXMRN-CQSZACIVSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	0
Rotatable bonds	4
Molecular weight (Da)	329.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

mGlu₅	GRM5	Human	Metabotropic glutamate	C	pKi	8.21	8.21	8.21	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

μ	OPRM	Human	Opioid	A	pEC50	5.00	5.00	5.00	ChEMBL
mGlu₅	GRM5	Rat	Metabotropic glutamate	C	pIC50	7.89	7.89	7.89	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4063837

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Distribution across phases (no. indications)

Phase I 0

Phase II 0

Phase III 0

Phase IV

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.