GPCRdb

CHEMBL3139110

Agent/drug
Bioactivity

CHEMBL3139110

SMILES	OCCN1CC[C@]23Cc4nc5ccccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc13
InChIKey	YCOUFAZMYVZKMK-UBFVSLLYSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	3
Rotatable bonds	2
Molecular weight (Da)	402.2

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	Mouse	Opioid	A	pKi	9.50	9.50	9.50	ChEMBL
κ	OPRK	Guinea pig	Opioid	A	pKi	7.22	7.22	7.22	ChEMBL
μ	OPRM	Mouse	Opioid	A	pKi	6.94	6.94	6.94	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pEC50	8.64	8.64	8.64	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	6.80	6.80	6.80	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL3139110

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.