GPCRdb

CHEMBL4070288

Agent/drug
Bioactivity

CHEMBL4070288

SMILES	CCc1ccc(C(=O)NCC2c3ccccc3CCN2C)cc1
InChIKey	RGAQWGCPPCLXIL-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	2
Hydrogen bond donors	1
Rotatable bonds	4
Molecular weight (Da)	308.2

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	8.64	8.64	8.64	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pIC50	6.72	6.72	6.72	ChEMBL
κ	OPRK	Human	Opioid	A	pIC50	6.31	6.31	6.31	ChEMBL
μ	OPRM	Human	Opioid	A	pIC50	5.48	5.48	5.48	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	8.00	8.00	8.00	ChEMBL

Showing 1 to 4 of 4 entries

CHEMBL4070288

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.