GPCRdb

CHEMBL1649944

Agent/drug
Bioactivity

CHEMBL1649944

SMILES	CCCC[C@@H](NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(N(C(=O)CC)c2ccccc2)CC1
InChIKey	NBCAOCVSBZCMGG-PDHQKIGBSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	4
Rotatable bonds	15
Molecular weight (Da)	717.4

Database connections

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	7.72	7.72	7.72	ChEMBL
μ	OPRM	Rat	Opioid	A	pKi	8.30	8.30	8.30	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Mouse	Opioid	A	pIC50	6.60	6.60	6.60	ChEMBL
δ	OPRD	Human	Opioid	A	pEC50	7.52	7.52	7.52	ChEMBL
δ	OPRD	Human	Opioid	A	pIC50	7.40	7.40	7.40	ChEMBL
μ	OPRM	Rat	Opioid	A	pEC50	7.72	7.72	7.72	ChEMBL
μ	OPRM	Rat	Opioid	A	pIC50	7.97	7.97	7.97	ChEMBL

Showing 1 to 5 of 5 entries

CHEMBL1649944

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.