CHEMBL2370964


SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=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 WSDYWWDQJYPQDS-KQWISETMSA-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 9.0 9.0 9.0 ChEMBL
MC3 MC3R Human Melanocortin A pKi 9.09 9.09 9.09 ChEMBL
MC4 MC4R Human Melanocortin A pKi 8.24 8.24 8.24 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 8.52 9.37 9.8 ChEMBL
MC1 MSHR Human Melanocortin A pIC50 9.13 9.59 10.13 ChEMBL
MC5 MC5R Human Melanocortin A pIC50 8.46 8.46 8.46 ChEMBL
MC5 MC5R Human Melanocortin A pEC50 8.42 8.42 8.42 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.52 7.65 8.21 ChEMBL
MC3 MC3R Human Melanocortin A pIC50 7.97 8.08 8.3 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 6.2 7.15 7.62 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 8.22 8.35 8.41 ChEMBL