CHEMBL3921327


SMILES CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)NNC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
InChIKey SOMLDFKHPJHCID-LYEJOWPUSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 19
Rotatable bonds 33
Molecular weight (Da) 1331.6

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 pEC50 8.55 8.55 8.55 ChEMBL
kisspeptin KISSR Human Kisspeptin A pEC50 9.25 9.25 9.25 ChEMBL