GPCRdb

CHEMBL31605

Agent/drug
Bioactivity

CHEMBL31605

SMILES	CO[C@]12C=CC3(CC14CCC(C)(C)[C@H]4O)C1Cc4ccc(O)c5c4C3(CCN1C)[C@@H]2O5
InChIKey	BELNGJAALXEXDR-JPTYMVJOSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	1
Molecular weight (Da)	423.2

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	Human	Opioid	A	pKi	8.07	8.07	8.07	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	8.89	8.89	8.89	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	9.30	9.30	9.30	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	7.73	7.73	7.73	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	8.80	8.80	8.80	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	9.10	9.10	9.10	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL31605

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.