CHEMBL4572994


SMILES CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2C[C@@H]1C(N)=O
InChIKey QHGVNDDQKJSMFK-GWMMUDDPSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 10
Rotatable bonds 17
Molecular weight (Da) 711.3

Drug properties

Molecular type Small molecule
Endogenous/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 7.0 7.0 7.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 8.3 8.3 8.3 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 9.52 9.52 9.52 ChEMBL
MC3 MC3R Mouse Melanocortin A pEC50 7.68 7.68 7.68 ChEMBL
MC4 MC4R Mouse Melanocortin A pEC50 6.8 6.8 6.8 ChEMBL