CHEMBL4540411


SMILES CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
InChIKey CNZBEMAMJJVIBN-SSUZURRFSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 8
Rotatable bonds 16
Molecular weight (Da) 775.2

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
MC4 MC4R Mouse Melanocortin A pKd 6.2 6.5 6.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 8.52 8.66 8.8 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 7.82 7.91 8.0 ChEMBL
MC4 MC4R Mouse Melanocortin A pEC50 5.89 6.14 6.39 ChEMBL