GPCRdb

CHEMBL379879

Agent/drug
Bioactivity

CHEMBL379879

SMILES	NC(N)=NCCC[C@H]1C[C@@H](OCc2ccc3ccccc3c2)CN1C(=O)[C@H](N)Cc1ccccc1
InChIKey	ZPOQUKYSTRZAFA-JIMJEQGWSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	3
Rotatable bonds	10
Molecular weight (Da)	473.3

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MC₁	MSHR	Human	Melanocortin	A	pKi	6.42	6.42	6.42	ChEMBL
MC₃	MC3R	Human	Melanocortin	A	pKi	5.91	5.91	5.91	ChEMBL
MC₄	MC4R	Human	Melanocortin	A	pKi	6.52	6.52	6.52	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MC₁	MSHR	Human	Melanocortin	A	pEC50	6.82	6.82	6.82	ChEMBL
MC₃	MC3R	Human	Melanocortin	A	pEC50	6.06	6.06	6.06	ChEMBL
MC₄	MC4R	Human	Melanocortin	A	pEC50	6.54	6.54	6.54	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL379879

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 0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.