CHEMBL242048


SMILES O=C(Nc1ccccc1)Oc1ccc2c(c1)C13CCCCC1C(C2)N(CC1CCC1)CC3
InChIKey UDWPHJLFGHTIHV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 430.3

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 8.41 8.41 8.41 ChEMBL
κ OPRK Human Opioid A pKi 10.29 10.29 10.29 ChEMBL
μ OPRM Human Opioid A pKi 9.92 9.92 9.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 8.66 8.66 8.66 ChEMBL
μ OPRM Human Opioid A pIC50 7.66 7.66 7.66 ChEMBL
μ OPRM Human Opioid A pEC50 8.89 8.89 8.89 ChEMBL