GPCRdb

CHEMBL222704

Agent/drug
Bioactivity

CHEMBL222704

SMILES	CCn1c2c(c3c1[C@@H]1Oc4c(O)ccc5c4[C@@]14CCN(C)C(C5)[C@]4(O)C3)CCCC2
InChIKey	JILRUXVVISWBOM-DYZJZLFBSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	1
Molecular weight (Da)	406.2

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	8.57	8.57	8.57	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.78	6.78	6.78	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	7.59	7.59	7.59	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	7.99	7.99	7.99	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	7.01	7.01	7.01	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	6.76	6.76	6.76	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL222704

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.