CHEMBL3634024


SMILES Cc1ccc([C@H](C)NC(=O)COc2cc(C)c3c(-c4ncccn4)nn(C)c3n2)cc1
InChIKey XEHRVSMGEOQPQE-INIZCTEOSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 416.2

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 8.4 8.4 8.4 ChEMBL
OX1 OX1R Human Orexin A pKd 7.96 7.96 7.96 ChEMBL
OX2 OX2R Human Orexin A pKi 8.3 8.3 8.3 ChEMBL
OX2 OX2R Human Orexin A pKd 7.89 7.89 7.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database