CHEMBL3961871


SMILES Cc1ccc(-n2nccn2)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H]3COc2ccc(F)cn2)n1
InChIKey WGJDXEJAXMDTDU-UAGQMJEPSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 408.2

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 Rat Orexin A pKi 8.05 8.05 8.05 ChEMBL
OX1 OX1R Human Orexin A pKi 7.85 7.85 7.85 ChEMBL
OX2 OX2R Human Orexin A pKi 6.96 7.0 7.03 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database