CHEMBL4113266


SMILES O=C(c1cccc(F)c1-c1ncccn1)N1[C@H]2CC[C@@H]1C[C@H]2Nc1ccc(C(F)(F)F)cn1
InChIKey BDCUQVJRZGYIDS-OLMNPRSZSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 457.2

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 Rat Orexin A pKi 7.82 7.82 7.82 ChEMBL
OX1 OX1R Human Orexin A pKi 8.05 8.07 8.1 ChEMBL
OX2 OX2R Human Orexin A pKi 5.96 5.96 5.96 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database