CHEMBL3634017


SMILES COc1ccc(CNC(=O)COc2cc(C(F)(F)F)c3c(-c4ccccc4)nn(C)c3n2)cc1
InChIKey KSZRPNZKQXWNEQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 470.2

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 6.1 6.1 6.1 ChEMBL
OX1 OX1R Human Orexin A pKd 5.91 5.91 5.91 ChEMBL
OX2 OX2R Human Orexin A pKi 7.08 7.08 7.08 ChEMBL
OX2 OX2R Human Orexin A pKd 6.39 6.39 6.39 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database