GPCRdb

CHEMBL388873

Agent/drug
Bioactivity

CHEMBL388873

SMILES	Oc1cccc([C@]23CCC[C@H]([C@H]2O)N(CCc2ccccc2)CC3)c1
InChIKey	YJDWRJHIVSZYJV-YPAWHYETSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	2
Rotatable bonds	4
Molecular weight (Da)	337.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Rat	Opioid	A	pKi	7.72	7.72	7.72	ChEMBL
δ	OPRD	Human	Opioid	A	pKi	7.89	7.89	7.89	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.74	6.74	6.74	ChEMBL
μ	OPRM	Rat	Opioid	A	pKi	9.58	9.58	9.58	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	9.72	9.72	9.72	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Rat	Opioid	A	pEC50	5.96	5.96	5.96	ChEMBL
μ	OPRM	Rat	Opioid	A	pEC50	7.66	7.66	7.66	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL388873

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.