CHEMBL4071063


SMILES CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1csc2ccccc12)C(N)=O
InChIKey OXZLRHPUSCOQNJ-YIPNQBBMSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 11
Rotatable bonds 20
Molecular weight (Da) 847.2

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 6.6 6.6 6.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 6.68 6.68 6.68 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 7.25 7.25 7.25 ChEMBL
MC3 MC3R Mouse Melanocortin A pEC50 6.8 6.8 6.8 ChEMBL
MC3 MC3R Mouse Melanocortin A pIC50 6.01 6.01 6.01 ChEMBL
MC4 MC4R Mouse Melanocortin A pIC50 7.03 7.03 7.03 ChEMBL