CHEMBL2435411


SMILES O=C1CCCC2(CCN(c3cnc4ccccc4n3)CC2)N1Cc1cccc2[nH]ccc12
InChIKey MPJDJGUFVOTTDY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 425.2

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 7.89 7.96 8.04 ChEMBL
OX1 OX1R Human Orexin A pKd 7.77 7.77 7.77 ChEMBL
OX2 OX2R Human Orexin A pKi 9.0 9.17 9.34 ChEMBL
OX2 OX2R Human Orexin A pKd 8.15 8.15 8.15 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database