CHEMBL6175484


SMILES N=C(N)NCCC[C@H]1CN(CCN(CCN2C[C@H](Cc3c[nH]cn3)N(CCc3ccc(F)cc3)C2=N)CCN2C(=N)NC[C@@H]2CCO)C(=N)N1CCCC1CCCCC1
InChIKey JLWPGHBCSQOAAO-QXUSSCGESA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 9
Rotatable bonds 24
Molecular weight (Da) 819.6

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 6.5 6.5 6.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pEC50 5.59 5.59 5.59 ChEMBL
MC1 MSHR Mouse Melanocortin A pEC50 6.07 6.07 6.07 ChEMBL
MC4 MC4R Mouse Melanocortin A pEC50 5.76 5.76 5.76 ChEMBL