CHEMBL466380


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

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 560.3

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
MC1 MSHR Human Melanocortin A pKi 5.86 5.86 5.86 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.7 6.7 6.7 ChEMBL
MC4 MC4R Human Melanocortin A pKi 8.1 8.1 8.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 5.97 5.97 5.97 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.95 6.95 6.95 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 8.52 8.52 8.52 ChEMBL