CHEMBL463047


SMILES CCC[C@H]1C(=O)N([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)CCN1C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cccnc1
InChIKey NVXVBSBXBTZZNU-RTOKGZNSSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 11
Molecular weight (Da) 623.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pKi 6.44 6.44 6.44 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.84 6.84 6.84 ChEMBL
MC4 MC4R Human Melanocortin A pKi 8.22 8.22 8.22 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 6.71 6.71 6.71 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.83 6.83 6.83 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.92 7.92 7.92 ChEMBL