HTL6641


SMILES COc1cc(cnc1OC)N1S(=O)(=O)c2c(N(C1=O)Cc1c(cc(cc1F)F)F)nccc2
InChIKey SUQZCEUKWPKXEE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 480.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 6TPN

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
OX1 OX1R Human Orexin A pKi 7.6 7.6 7.6 Guide to Pharmacology
OX2 OX2R Human Orexin A pKi 8.45 8.45 8.45 Guide to Pharmacology
OX1 OX1R Human Orexin A pKi 7.5 7.6 7.7 ChEMBL
OX2 OX2R Human Orexin A pKi 8.3 8.45 8.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database