CHEMBL6145322


SMILES CCOc1ccc(CCN2C(=N)N(CCN(CCN3C[C@H]([C@@H](C)O)N(CCc4ccc(F)cc4)C3=N)CCN3C(=N)NC[C@@H]3CCO)C[C@@H]2CCCNC(=N)N)cc1
InChIKey KXDWQWPLUBDDIU-MYLNTLEBSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 9
Rotatable bonds 24
Molecular weight (Da) 807.5

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 6.3 6.3 6.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 6.13 6.13 6.13 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 6.78 6.78 6.78 ChEMBL
MC4 MC4R Mouse Melanocortin A pEC50 5.79 5.79 5.79 ChEMBL