CHEMBL4538274


SMILES CC(C)[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
InChIKey LPATVOINCAVXRL-NTBYCYSFSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 10
Rotatable bonds 13
Molecular weight (Da) 1004.5

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pKd 6.1 6.1 6.1 ChEMBL
MC3 MC3R Mouse Melanocortin A pKd 5.9 5.9 5.9 ChEMBL
MC4 MC4R Mouse Melanocortin A pKd 7.2 7.2 7.2 ChEMBL
MC4 MC4R Human Melanocortin A pKd 7.8 7.8 7.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Mouse Melanocortin A pIC50 4.54 4.54 4.54 ChEMBL
MC1 MSHR Mouse Melanocortin A pIC50 4.82 4.82 4.82 ChEMBL
MC3 MC3R Mouse Melanocortin A pIC50 4.28 4.28 4.28 ChEMBL
MC4 MC4R Mouse Melanocortin A pIC50 7.42 7.42 7.42 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 6.6 6.6 6.6 ChEMBL