CHEMBL4856018


SMILES C/C=C1/CN2[C@H]3C[C@@H]1[C@](CO)(C(=O)OC)[C@@H]2Cc1c3[nH]c2ccccc12
InChIKey RCEFXZXHYFOPIE-GJZACXSBSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 352.2

Drug properties

Molecular type Small molecule
Endogenous/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 4.8 4.81 4.82 ChEMBL
κ OPRK Human Opioid A pKi 4.8 4.82 4.85 ChEMBL
μ OPRM Human Opioid A pKi 6.5 6.5 6.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Mouse Opioid A pIC50 5.5 5.5 5.5 ChEMBL
δ OPRD Mouse Opioid A pIC50 4.8 4.8 4.81 ChEMBL