CHEMBL453300


SMILES CCC[C@H]1C(=O)N([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)CCN1C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cscn1
InChIKey NOMHNUFAKKUFFP-GGCFSWKVSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 11
Molecular weight (Da) 629.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pKi 5.8 5.8 5.8 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.37 6.37 6.37 ChEMBL
MC4 MC4R Human Melanocortin A pKi 7.44 7.44 7.44 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 6.06 6.06 6.06 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 5.96 5.96 5.96 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.43 7.43 7.43 ChEMBL