GPCRdb

CHEMBL3609620

Agent/drug
Bioactivity

CHEMBL3609620

SMILES	Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIKey	ZGKMSCDQIDVSIK-FNFCYJGBSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	5
Rotatable bonds	11
Molecular weight (Da)	692.2

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	9.10	9.10	9.10	ChEMBL
μ	OPRM	Rat	Opioid	A	pKi	9.52	9.52	9.52	ChEMBL
NK₁	NK1R	Rat	Tachykinin	A	pKi	9.55	9.55	9.55	ChEMBL
NK₁	NK1R	Human	Tachykinin	A	pKi	10.80	10.80	10.80	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Mouse	Opioid	A	pIC50	6.40	6.40	6.40	ChEMBL
δ	OPRD	Human	Opioid	A	pEC50	7.92	7.92	7.92	ChEMBL
μ	OPRM	Rat	Opioid	A	pEC50	8.80	8.80	8.80	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL3609620

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.