CHEMBL606990


SMILES N=C(N)NCCC[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]2CCCN2C(=O)CCC(=O)NCCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O
InChIKey RSZGGZUMSYSTES-HJCKZFGESA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 10
Rotatable bonds 9
Molecular weight (Da) 813.4

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
MC5 MC5R Human Melanocortin A pKi 6.0 6.0 6.0 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.41 6.41 6.41 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.72 6.72 6.72 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC5 MC5R Human Melanocortin A pEC50 5.89 5.89 5.89 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.1 6.1 6.1 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 5.64 5.64 5.64 ChEMBL