CHEMBL384774


SMILES CNC(=O)[C@H](Cc1ccc2ccccc2c1)N1CCN(C(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(C)=O)[C@@H](CCCN=C(N)N)C1=O
InChIKey KOWZSZLHPBJHEB-HWFRFQLBSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 16
Molecular weight (Da) 754.4

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 8.7 8.7 8.7 ChEMBL
MC3 MC3R Human Melanocortin A pKi 7.46 7.46 7.46 ChEMBL
MC4 MC4R Human Melanocortin A pKi 8.3 8.3 8.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 8.77 8.77 8.77 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 8.22 8.22 8.22 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 8.7 8.7 8.7 ChEMBL