CHEMBL3586413


SMILES COc1cccc(OC)c1C(=O)N1C[C@H]2CN(c3nc4ccc(Cl)cc4s3)C[C@H]2C1
InChIKey KQRJYENNYTUWHU-OKILXGFUSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 443.1

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 5.16 5.16 5.16 ChEMBL
OX2 OX2R Human Orexin A pKi 5.66 5.73 5.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database