CHEMBL5417913


SMILES CC(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=O
InChIKey UGNYHTRDBISTGJ-MBEDZMRZSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 9
Rotatable bonds 18
Molecular weight (Da) 822.2

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
MC5 MC5R Mouse Melanocortin A pKd 5.9 5.9 5.9 ChEMBL
MC5 MC5R Mouse Melanocortin A pKi 5.89 5.89 5.89 ChEMBL
MC1 MSHR Mouse Melanocortin A pKd 6.6 6.6 6.6 ChEMBL
MC1 MSHR Mouse Melanocortin A pKi 6.6 6.6 6.6 ChEMBL
MC4 MC4R Mouse Melanocortin A pKd 7.8 7.8 7.8 ChEMBL
MC4 MC4R Mouse Melanocortin A pKi 7.8 7.8 7.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Mouse Melanocortin A pEC50 6.4 6.4 6.4 ChEMBL