GPCRdb

CHEMBL5418819

Agent/drug
Bioactivity

CHEMBL5418819

SMILES	CN(C)C(=O)C(CCN1CCC(CCN2CCN(c3cccc(Cl)c3Cl)CC2)C1)(c1ccccc1)c1ccccc1
InChIKey	QMUUXLBLOLIMJC-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	0
Rotatable bonds	10
Molecular weight (Da)	592.3

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

μ	OPRM	Human	Opioid	A	pKi	7.63	7.63	7.63	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	6.93	6.93	6.93	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	7.70	7.70	7.70	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

μ	OPRM	Mouse	Opioid	A	pEC50	6.18	6.44	6.80	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	7.38	7.38	7.38	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL5418819

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.