CHEMBL3600914


SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@@H](C(N)=O)N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O
InChIKey UAISFSHHKXHKOI-JGNQAYRUSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 11
Rotatable bonds 17
Molecular weight (Da) 1115.6

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
MC3 MC3R Human Melanocortin A pKd 8.5 8.5 8.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pIC50 6.61 6.61 6.61 ChEMBL
MC5 MC5R Human Melanocortin A pIC50 8.18 8.18 8.18 ChEMBL
MC3 MC3R Human Melanocortin A pIC50 8.01 8.01 8.01 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 6.69 6.69 6.69 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 8.3 8.3 8.3 ChEMBL