CHEMBL3586420


SMILES O=C(c1ccccc1-c1cccs1)N1C[C@H]2CN(c3nc4ccc(F)cc4s3)C[C@H]2C1
InChIKey XYTIODGLHMARHP-IYBDPMFKSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 449.1

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
OX1 OX1R Human Orexin A pKi 6.57 6.57 6.57 ChEMBL
OX2 OX2R Human Orexin A pKi 6.86 6.86 6.86 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database