CHEMBL2151643


SMILES CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=S)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
InChIKey PXFFUPQUPMYUML-OPOFVLAOSA-N

Chemical properties

Hydrogen bond acceptors 16
Hydrogen bond donors 19
Rotatable bonds 38
Molecular weight (Da) 1331.6

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
kisspeptin KISSR Rat Kisspeptin A pIC50 8.48 8.48 8.48 ChEMBL
kisspeptin KISSR Human Kisspeptin A pIC50 8.55 8.55 8.55 ChEMBL
kisspeptin KISSR Human Kisspeptin A pEC50 10.39 10.39 10.39 ChEMBL