GPCRdb

CHEMBL194493

Agent/drug
Bioactivity

CHEMBL194493

SMILES	O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccc([N+](=O)[O-])cc1
InChIKey	DWDPBNBMFRTKEL-OWOJBTEDSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	448.1

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pKi	7.51	7.64	7.71	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	8.46	8.92	9.15	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pIC50	7.86	7.86	7.86	ChEMBL
D₂	DRD2	Human	Dopamine	A	pEC50	7.86	7.86	7.86	ChEMBL
D₃	DRD3	Human	Dopamine	A	pIC50	8.66	8.66	8.66	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	8.66	8.66	8.66	ChEMBL

Showing 1 to 4 of 4 entries

CHEMBL194493

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.