U50,488H


SMILES CN(C1CCCCC1N2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl.CS(=O)(=O)O
InChIKey OJPHNZCUXUUVKU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 464.1

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
μ OPRM Human Opioid A pKi 6.0 6.51 7.0 PDSP Ki database
δ OPRD Human Opioid A pKi 5.0 6.0 7.0 PDSP Ki database
κ OPRK Human Opioid A pKi 7.96 9.06 9.92 PDSP Ki database
κ OPRK Guinea pig Opioid A pKi 6.52 8.55 9.7 PDSP Ki database
δ A0A286XTF2 Guinea pig Opioid A pKi 5.0 5.3 5.6 PDSP Ki database
μ OPRM Mouse Opioid A pKi 6.47 6.51 6.55 PDSP Ki database
κ OPRK Rat Opioid A pKi 6.54 7.25 7.96 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database