CHEMBL375559


SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](OCc2ccc3ccccc3c2)C[C@@H]1C(=O)NCCN=C(N)N
InChIKey VZGJDZXPTNTGFA-AOJHZZQJSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 15
Molecular weight (Da) 707.3

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 5.69 5.69 5.69 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.3 6.3 6.3 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.25 6.25 6.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 5.87 5.87 5.87 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 5.91 5.91 5.91 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 6.59 6.59 6.59 ChEMBL