GPCRdb

CHEMBL2113666

Agent/drug
Bioactivity

CHEMBL2113666

SMILES	CN1CC[C@]23c4c5cccc4O[C@H]2C(=O)CC[C@@]3(NC(=O)/C=C/c2ccccc2Cl)[C@H]1C5
InChIKey	IMIGYXVXIBPZFP-MOXYHQKCSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	3
Molecular weight (Da)	448.2

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	10.10	10.10	10.10	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	9.27	9.27	9.27	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	9.82	9.82	9.82	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	10.00	10.00	10.00	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	10.00	10.00	10.00	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	10.40	10.40	10.40	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL2113666

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.