CHEMBL4754987


SMILES CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1Cc2ccccc2C[C@@H]1C(N)=O
InChIKey HSJMNXXZYVFSJQ-PSWJWLENSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 8
Rotatable bonds 16
Molecular weight (Da) 734.4

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
MC4 MC4R Mouse Melanocortin A pKd 6.5 6.5 6.5 ChEMBL
MC4 MC4R Mouse Melanocortin A pKi 6.5 6.5 6.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 7.58 7.58 7.58 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 9.05 9.05 9.05 ChEMBL
MC3 MC3R Mouse Melanocortin A pEC50 7.41 7.41 7.41 ChEMBL