CHEMBL388586


SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
InChIKey CSDUUNOZBMGMHZ-CUPIEXAXSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 10
Rotatable bonds 21
Molecular weight (Da) 798.4

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
NPFF1 NPFF1 Human Neuropeptide FF/neuropeptide AF A pIC50 6.8 6.8 6.8 ChEMBL
NPFF2 NPFF2 Human Neuropeptide FF/neuropeptide AF A pIC50 5.75 5.75 5.75 ChEMBL
kisspeptin KISSR Human Kisspeptin A pEC50 9.16 9.25 9.35 ChEMBL
kisspeptin KISSR Human Kisspeptin A pIC50 9.15 9.15 9.15 ChEMBL