CHEMBL473068


SMILES CNCCN1CN(c2ccccc2)C2(CCN(C(c3ccccc3Cl)c3ccccc3Cl)CC2)C1=O
InChIKey DIUXCEUBKUBNAR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 522.2

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
NOP OPRX Human Opioid A pKi 8.39 8.39 8.39 ChEMBL
δ OPRD Human Opioid A pKi 6.24 6.24 6.24 ChEMBL
κ OPRK Human Opioid A pKi 6.06 6.06 6.06 ChEMBL
μ OPRM Human Opioid A pKi 5.97 5.97 5.97 ChEMBL
δ OPRD Human Opioid A pKi 6.24 6.24 6.24 PDSP Ki database
NOP OPRX Human Opioid A pKi 8.39 8.39 8.39 PDSP Ki database
κ OPRK Human Opioid A pKi 6.06 6.06 6.06 PDSP Ki database
μ OPRM Human Opioid A pKi 5.97 5.97 5.97 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database