CHEMBL107420


SMILES COc1ccc2c(c1O)[C@]13CCN(C)C(C2)[C@@]12C/C(=C(/C)c1ccccc1)[C@@H]3c1[nH]c3ccccc3c1C2
InChIKey JIODEYLJTASFJC-KQVVFFMJSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 502.3

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
δ OPRD Human Opioid A pKi 7.63 7.63 7.63 ChEMBL
κ OPRK Human Opioid A pKi 9.21 9.21 9.21 ChEMBL
μ OPRM Human Opioid A pKi 7.87 7.87 7.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.43 6.43 6.43 ChEMBL
κ OPRK Human Opioid A pEC50 7.08 7.08 7.08 ChEMBL
μ OPRM Human Opioid A pEC50 6.86 6.86 6.86 ChEMBL