GPCRdb

CHEMBL269004

Agent/drug
Bioactivity

CHEMBL269004

SMILES	CCCN(CCC)[C@H]1CCc2c(O)cccc2C1
InChIKey	MDBWEQVKJDMEMK-AWEZNQCLSA-N

Chemical Properties

Hydrogen bond acceptors	2
Hydrogen bond donors	1
Rotatable bonds	5
Molecular weight (Da)	247.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb
Ligand site mutations	D₃

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

β₂	ADRB2	Human	Adrenoceptors	A	pKi	4.40	4.40	4.40	ChEMBL
D₂	DRD2	Rat	Dopamine	A	pKi	6.82	7.07	7.23	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.85	8.07	8.22	ChEMBL
D₃	DRD3	Rat	Dopamine	A	pKi	8.68	8.79	8.87	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	9.27	9.27	9.27	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	7.33	7.33	7.33	ChEMBL

Showing 1 to 6 of 6 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pEC50	7.39	7.39	7.39	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	9.20	9.20	9.20	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL269004

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
Ligand site mutations	D₃

Compound is not listed as a drug.