GPCRdb

CHEMBL2208350

Agent/drug
Bioactivity

CHEMBL2208350

SMILES	COc1ccc(-c2ccc(CCNC(=O)c3ccc4c(c3)C3(C)CCN(CC5CC5)C(C4)C3C)cc2)cc1OC
InChIKey	PWHGDVUYVPECPZ-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	9
Molecular weight (Da)	538.3

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	8.82	8.82	8.82	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	8.89	8.89	8.89	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pIC50	7.16	7.16	7.16	ChEMBL
δ	OPRD	Human	Opioid	A	pEC50	8.21	8.21	8.21	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	8.52	8.52	8.52	ChEMBL
μ	OPRM	Human	Opioid	A	pIC50	7.54	7.54	7.54	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	8.80	8.80	8.80	ChEMBL

Showing 1 to 5 of 5 entries

CHEMBL2208350

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.