GPCRdb

CHEMBL190785

Agent/drug
Bioactivity

CHEMBL190785

SMILES	COC(=O)[C@@H]1C[C@H](OC(=O)Nc2ccccc2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
InChIKey	IHDOVLHHTAJFKU-XAGHGKQISA-N

Chemical Properties

Hydrogen bond acceptors	8
Hydrogen bond donors	1
Rotatable bonds	4
Molecular weight (Da)	509.2

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	6.64	6.64	6.64	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	7.03	7.03	7.03	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	7.80	7.80	7.80	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	5.60	5.60	5.60	ChEMBL
κ	OPRK	Human	Opioid	A	pEC50	6.32	6.32	6.32	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	6.23	6.23	6.23	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL190785

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.