CHEMBL3394842


SMILES C[C@@H]1CC[C@@H](Oc2ccnc3c(F)cccc23)CN1C(=O)c1ccccc1-n1nccn1
InChIKey BVUZOFDSUCGTDO-IAGOWNOFSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 431.2

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 6.01 6.01 6.01 ChEMBL
OX2 OX2R Human Orexin A pKi 9.22 9.24 9.26 ChEMBL
OX1 OX1R Rat Orexin A pKi 6.25 6.25 6.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
OX1 OX1R Human Orexin A pIC50 5.41 5.41 5.41 ChEMBL
OX2 OX2R Human Orexin A pIC50 7.75 7.75 7.75 ChEMBL