GPCRdb

CHEMBL467586

Agent/drug
Bioactivity

CHEMBL467586

SMILES	CNCC(=O)N[C@H](c1cc(Cl)ccc1N1CCN(C(=O)[C@H](C)Cc2ccc(Cl)cc2OC)CC1)C(C)C
InChIKey	CETOWTIWZXCWLA-WINIVTDRSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	10
Molecular weight (Da)	548.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MC₃	MC3R	Human	Melanocortin	A	pKi	6.80	6.80	6.80	ChEMBL
MC₄	MC4R	Human	Melanocortin	A	pKi	8.96	8.96	8.96	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pKi	7.89	7.89	7.89	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MC₄	MC4R	Human	Melanocortin	A	pIC50	6.54	6.54	6.54	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL467586

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.