GPCRdb

CHEMBL4594933

Agent/drug
Bioactivity

CHEMBL4594933

SMILES	Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3cnc4ccccc4c3)cc21
InChIKey	MCWBRXHJUBHJOG-LITSAYRRSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	4
Rotatable bonds	6
Molecular weight (Da)	480.3

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Rat	Opioid	A	pKi	8.82	8.82	8.82	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	7.80	7.80	7.80	ChEMBL
μ	OPRM	Rat	Opioid	A	pKi	10.00	10.00	10.00	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

μ	OPRM	Rat	Opioid	A	pEC50	8.66	8.66	8.66	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL4594933

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

Compound is not listed as a drug.