CHEMBL406276


SMILES CCCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
InChIKey FZMMHTRNAWCOMM-ORYMTKCHSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 9
Rotatable bonds 21
Molecular weight (Da) 727.4

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 7.69 7.69 7.69 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.77 6.77 6.77 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.92 6.92 6.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 8.7 8.7 8.7 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 7.35 7.35 7.35 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.58 7.58 7.58 ChEMBL