GPCRdb

CHEMBL4650976

Agent/drug
Bioactivity

CHEMBL4650976

No image available

SMILES	Cc1cc(=O)oc2ccc(N3C(=O)C4=C(SC[C@@H](NC(=O)[C@@H](N)Cc5ccc(O)cc5)C(=O)NCC(=O)N[C@@H](Cc5ccccc5)C(=O)NNC(=O)[C@H](Cc5ccccc5)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc5ccc(O)cc5)CS4)C3=O)cc12
InChIKey	RBERMBLBNHQMAK-NKQBFHEZSA-N

Chemical Properties

Hydrogen bond acceptors	18
Hydrogen bond donors	12
Rotatable bonds	13
Molecular weight (Da)	1223.4

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	Human	Opioid	A	pKi	6.92	6.92	6.92	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	6.10	6.10	6.10	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pEC50	6.72	6.72	6.72	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	5.39	5.39	5.39	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	6.54	6.54	6.54	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL4650976

No image available

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.