GPCRdb

CHEMBL5394355

Agent/drug
Bioactivity

CHEMBL5394355

SMILES	CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4ccc(C(F)(F)F)o4)cc4ccccc43)CC2)CC1
InChIKey	MPJOIXWGAIBSAW-GRGXKFILSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	6
Molecular weight (Da)	515.3

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	7.20	7.20	7.20	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.60	6.60	6.60	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	7.82	7.82	7.82	ChEMBL
NOP	OPRX	Human	Opioid	A	pKi	8.47	8.47	8.47	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pEC50	6.30	6.30	6.30	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	7.22	7.22	7.22	ChEMBL
NOP	OPRX	Human	Opioid	A	pEC50	7.26	7.26	7.26	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL5394355

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.