CHEMBL518325


SMILES CC(C)NCCN1CN(c2ccccc2)C2(CCN(C(c3ccccc3Cl)c3ccccc3Cl)CC2)C1=O
InChIKey XPASHGDCAWWZDI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 550.2

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 8.59 8.59 8.59 ChEMBL
δ OPRD Human Opioid A pKi 6.02 6.02 6.02 ChEMBL
κ OPRK Human Opioid A pKi 6.33 6.33 6.33 ChEMBL
μ OPRM Human Opioid A pKi 6.13 6.13 6.13 ChEMBL
NOP OPRX Human Opioid A pKi 8.59 8.59 8.59 PDSP Ki database
κ OPRK Human Opioid A pKi 6.33 6.33 6.33 PDSP Ki database
μ OPRM Human Opioid A pKi 6.13 6.13 6.13 PDSP Ki database
δ OPRD Human Opioid A pKi 6.02 6.02 6.02 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database