CHEMBL460142


SMILES CNC(=O)[C@H](Cc1ccc2ccccc2c1)N1CCN(C(=O)[C@H](N)Cc2ccc(F)cc2)[C@@H](C(C)C)C1=O
InChIKey SUZIFVSOOKUPKE-PVHODMMVSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 518.3

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
MC1 MSHR Human Melanocortin A pKi 5.0 5.0 5.0 ChEMBL
MC3 MC3R Human Melanocortin A pKi 5.73 5.73 5.73 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.15 6.15 6.15 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 5.82 5.82 5.82 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.57 6.57 6.57 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.08 7.08 7.08 ChEMBL