Chembl2048767


SMILES O=[N+]([O-])c1cccc(CNc2ccc3c(c2)[C@@]24CCCC[C@H]2[C@@H](C3)N(CC2CCC2)CC4)c1
InChIKey ZONATBMJYVOZDG-KJYTXNCISA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 445.3

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 6.82 6.82 6.82 ChEMBL
κ OPRK Human Opioid A pEC50 9.1 9.1 9.1 ChEMBL
κ OPRK Human Opioid A pKi 8.96 8.96 8.96 ChEMBL
μ OPRM Human Opioid A pIC50 8.17 8.17 8.17 ChEMBL
μ OPRM Human Opioid A pEC50 8.96 8.96 8.96 ChEMBL
μ OPRM Human Opioid A pKi 9.37 9.37 9.37 ChEMBL