CHEMBL4066752


SMILES O=C(c1ccccc1)N1C[C@H]2OC34CCC1C2C31CCN(CC2CC2)C4Cc2ccc(O)cc21
InChIKey KEVICIVUCJDWDH-BTNQZZBKSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 456.2

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 Mouse Opioid A pKi 9.49 9.49 9.49 ChEMBL
δ OPRD Mouse Opioid A pKi 9.56 9.56 9.56 ChEMBL
κ OPRK Guinea pig Opioid A pKi 8.92 8.92 8.92 ChEMBL
δ OPRD Human Opioid A pKi 9.81 9.81 9.81 ChEMBL
κ OPRK Human Opioid A pKi 8.98 8.98 8.98 ChEMBL
μ OPRM Human Opioid A pKi 9.2 9.2 9.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 9.27 9.27 9.27 ChEMBL