GPCRdb

CHEMBL608246

Agent/drug
Bioactivity

CHEMBL608246

SMILES	CCO[C@@]12Cc3c([nH]c4ccccc34)[C@]3(C)Oc4c(O)ccc5c4[C@]13CCN(C)[C@@H]2C5
InChIKey	SHXTYPBRXDOEOV-IFKAHUTRSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	2
Rotatable bonds	2
Molecular weight (Da)	416.2

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	8.05	8.23	8.41	ChEMBL
κ	OPRK	Rat	Opioid	A	pKi	6.54	6.54	6.54	ChEMBL
κ	OPRK	Guinea pig	Opioid	A	pKi	6.14	6.34	6.54	ChEMBL
μ	OPRM	Rat	Opioid	A	pKi	6.15	6.20	6.29	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Rat	Opioid	A	pEC50	6.98	6.98	6.98	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL608246

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.