CHEMBL4163787


SMILES CCCC[C@@H]1NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O
InChIKey AQTAIKFZTTZGCE-ZHECQJHESA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 13
Rotatable bonds 17
Molecular weight (Da) 1014.6

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC3 MC3R Mouse Melanocortin A pKd 7.9 7.9 7.9 ChEMBL
MC4 MC4R Mouse Melanocortin A pKd 9.5 9.5 9.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Mouse Melanocortin A pEC50 6.4 6.4 6.4 ChEMBL