Chembl402189


SMILES COc1cc(CC(=O)N(C)[C@H](CN2CCCC2)c2ccccc2)c(S(=O)(=O)N2CCOCC2)cc1OC
InChIKey NMAGBJWNYCHJFX-HSZRJFAPSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 10
Molecular weight (Da) 531.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 8.03 8.03 8.03 ChEMBL
κ OPRK Human Opioid A pKi 9.26 9.26 9.26 ChEMBL
κ OPRK Human Opioid A pEC50 9.77 9.77 9.77 ChEMBL
μ OPRM Human Opioid A pKi 7.82 7.82 7.82 ChEMBL