CHEMBL2151648


SMILES CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
InChIKey CEWNJUYXNWFJPJ-VCOSCHOPSA-N

Chemical properties

Hydrogen bond acceptors 17
Hydrogen bond donors 20
Rotatable bonds 35
Molecular weight (Da) 1231.6

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
kisspeptin KISSR Rat Kisspeptin A pIC50 9.08 9.08 9.08 ChEMBL
kisspeptin KISSR Human Kisspeptin A pEC50 9.62 9.62 9.62 ChEMBL
kisspeptin KISSR Human Kisspeptin A pIC50 9.07 9.07 9.07 ChEMBL