GPCRdb

CHEMBL5412738

Agent/drug
Bioactivity

CHEMBL5412738

SMILES	CC(=O)NCc1cc2ccccc2n1C1CCN([C@H]2CC[C@@H](C(C)C)CC2)CC1
InChIKey	VEFKNVILUVRTOC-GRGXKFILSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	1
Rotatable bonds	5
Molecular weight (Da)	395.3

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pKi	7.09	7.09	7.09	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.75	6.75	6.75	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	7.61	7.61	7.61	ChEMBL
NOP	OPRX	Human	Opioid	A	pKi	8.80	8.80	8.80	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pEC50	6.87	6.87	6.87	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	6.95	6.95	6.95	ChEMBL
NOP	OPRX	Human	Opioid	A	pEC50	7.30	7.30	7.30	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL5412738

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.