GPCRdb

CHEMBL4160748

Agent/drug
Bioactivity

CHEMBL4160748

SMILES	COc1ccc(-c2c(C)nn3c(C(F)(F)F)cc(C)nc23)c(F)c1F
InChIKey	NYBZCKAQIIPSDS-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	0
Rotatable bonds	2
Molecular weight (Da)	357.1

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

NK₁	NK1R	Human	Tachykinin	A	pKi	6.19	6.19	6.19	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

mGlu₇	GRM7	Human	Metabotropic glutamate	C	pEC50	6.19	6.19	6.19	ChEMBL
mGlu₇	GRM7	Rat	Metabotropic glutamate	C	pEC50	6.19	6.19	6.19	ChEMBL
mGlu₈	GRM8	Rat	Metabotropic glutamate	C	pEC50	5.58	5.58	5.58	ChEMBL
mGlu₈	GRM8	Human	Metabotropic glutamate	C	pEC50	5.58	5.58	5.58	ChEMBL
NK₁	NK1R	Human	Tachykinin	A	pIC50	5.47	5.47	5.47	ChEMBL

Showing 1 to 5 of 5 entries

CHEMBL4160748

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Clinical Trials

Phase I 0

Phase II 0

Phase III 0

Approved No

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.