GPCRdb

CHEMBL4875858

Agent/drug
Bioactivity

CHEMBL4875858

SMILES	O=[N+]([O-])C1=Cc2cc(I)ccc2OC1C(F)(F)F
InChIKey	OPOOLSURVZPHRO-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	0
Rotatable bonds	1
Molecular weight (Da)	370.9

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_2A	ADA2A	Human	Adrenoceptors	A	pKi	5.32	5.32	5.32	ChEMBL
D₅	DRD5	Human	Dopamine	A	pKi	5.80	5.80	5.80	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

P2Y₆	P2RY6	Mouse	P2Y	A	pIC50	4.54	4.54	4.54	ChEMBL
P2Y₆	P2RY6	Human	P2Y	A	pIC50	5.40	5.40	5.40	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4875858

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.