GPCRdb

CHEMBL112065

Agent/drug
Bioactivity

CHEMBL112065

SMILES	COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIKey	OJZXUFDBDMQATJ-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	9
Molecular weight (Da)	443.3

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb
Ligand site mutations	D₂

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₁	DRD1	Pig	Dopamine	A	pKi	6.24	6.24	6.24	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.12	7.27	7.38	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	6.10	8.58	9.80	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKd	7.40	7.40	7.40	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	7.57	7.57	7.57	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pEC50	7.92	7.92	7.92	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL112065

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 ChEMBL_compound_ids PubChem GPCRdb
Ligand site mutations	D₂

Compound is not listed as a drug.