CHEMBL460138


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

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight (Da) 518.3

Drug properties

Molecular type Small molecule
Endogenous/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 5.0 5.0 5.0 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.14 6.14 6.14 ChEMBL
MC4 MC4R Human Melanocortin A pKi 7.12 7.12 7.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 5.82 5.82 5.82 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.83 6.83 6.83 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.55 7.55 7.55 ChEMBL