CHEMBL4078495


SMILES CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
InChIKey UUHBORGJBOZMRT-FLLNZLDLSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 7
Rotatable bonds 15
Molecular weight (Da) 844.3

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
MC4 MC4R Mouse Melanocortin A pKd 6.4 6.4 6.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 6.6 6.6 6.6 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 8.15 8.15 8.15 ChEMBL
MC3 MC3R Mouse Melanocortin A pEC50 6.22 6.22 6.22 ChEMBL
MC3 MC3R Mouse Melanocortin A pIC50 6.38 6.38 6.38 ChEMBL
MC4 MC4R Mouse Melanocortin A pIC50 7.37 7.37 7.37 ChEMBL