CHEMBL5193254


SMILES COc1cccc(C(=O)Nc2cccc([C@]3(C)O[C@@H]4N5[C@H](CO[C@H]53)O[C@@]4(C)c3cccc(NC(=O)c4ccccc4)c3)c2)c1
InChIKey KWZATPHLNBHNFW-VYKSXFOXSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 591.2

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
OX1 OX1R Human Orexin A pKi 8.12 8.12 8.12 ChEMBL
OX2 OX2R Human Orexin A pKi 8.27 8.27 8.27 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database