CHEMBL3634013


SMILES COc1ccc([C@H](C)NC(=O)COc2cc(C(F)(F)F)c3c(-c4ccccc4)nn(C)c3n2)cc1
InChIKey GUDQJFKBBOAOIC-HNNXBMFYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 484.2

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 Human Orexin A pKd 8.1 8.12 8.15 ChEMBL
OX1 OX1R Human Orexin A pKi 7.85 7.97 8.1 ChEMBL
OX2 OX2R Human Orexin A pKd 8.4 8.46 8.52 ChEMBL
OX2 OX2R Human Orexin A pKi 8.4 8.55 8.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database