GPCRdb

CHEMBL1682209

Agent/drug
Bioactivity

CHEMBL1682209

SMILES	COCC(=O)N[C@H]1Cc2ccc(OC)c(c2)Cc2ccc(cc2)Oc2cccc(c2)CN(CCCN2CCN(CCCN)CC2)C1=O
InChIKey	QXSMBSQHYONEJF-UMSFTDKQSA-N

Chemical Properties

Hydrogen bond acceptors	8
Hydrogen bond donors	2
Rotatable bonds	11
Molecular weight (Da)	643.4

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	6.94	6.94	6.94	ChEMBL
MC₃	MC3R	Human	Melanocortin	A	pKi	5.93	5.93	5.93	ChEMBL
MC₄	MC4R	Human	Melanocortin	A	pKi	6.41	6.41	6.41	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pKi	6.41	6.41	6.41	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MC₁	MSHR	Human	Melanocortin	A	pEC50	7.80	7.80	7.80	ChEMBL
MC₄	MC4R	Human	Melanocortin	A	pEC50	6.33	6.33	6.33	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL1682209

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.