CHEMBL2370968


SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O
InChIKey ZTSQVRSYAGAZPG-MBXNTMTISA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Protein
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
MC5 MC5R Human Melanocortin A pKi 7.85 7.85 7.85 ChEMBL
MC3 MC3R Human Melanocortin A pKi 9.7 9.7 9.7 ChEMBL
MC4 MC4R Human Melanocortin A pKi 9.66 9.66 9.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pIC50 8.2 8.2 8.2 ChEMBL
MC1 MSHR Human Melanocortin A pEC50 8.91 8.91 8.92 ChEMBL
MC5 MC5R Human Melanocortin A pEC50 8.38 8.39 8.39 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 5.77 5.77 5.77 ChEMBL
MC3 MC3R Human Melanocortin A pIC50 7.99 7.99 7.99 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 7.3 7.3 7.3 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 8.4 8.4 8.4 ChEMBL