CHEMBL4076681


SMILES O=C(Oc1ccccc1)N1C[C@H]2CC34CCC1C2C31CCN(CC2CC2)C4Cc2ccc(O)cc21
InChIKey HZJINPRTUNCNCB-MPZSKYPWSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 470.3

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 9.08 9.08 9.08 ChEMBL
κ OPRK Human Opioid A pKi 9.28 9.28 9.28 ChEMBL
μ OPRM Human Opioid A pKi 9.08 9.08 9.08 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.89 8.89 8.89 ChEMBL
κ OPRK Human Opioid A pEC50 8.6 8.6 8.6 ChEMBL