CHEMBL2435402


SMILES COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
InChIKey PCMHOSYCWRRHTG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 405.2

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 Mouse Orexin A pKi 6.34 6.34 6.34 ChEMBL
OX2 OX2R Mouse Orexin A pKi 7.23 7.23 7.23 ChEMBL
OX1 OX1R Human Orexin A pKi 6.29 6.29 6.29 ChEMBL
OX2 OX2R Human Orexin A pKi 7.85 7.85 7.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database