CHEMBL4111383


SMILES Cc1ccc(-c2ncccn2)c(C(=O)N2[C@H]3CC[C@@H]2[C@@H](COc2ccccn2)C3)n1
InChIKey WKBJARZMMUKHBI-ZIFCJYIRSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 401.2

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 Rat Orexin A pKi 7.62 7.62 7.62 ChEMBL
OX1 OX1R Human Orexin A pKi 7.72 7.72 7.72 ChEMBL
OX2 OX2R Human Orexin A pKi 6.57 6.57 6.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database