CHEMBL391486


SMILES COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(N)=O)c4ccccc43)CC2)C(C)C)c1
InChIKey CDYNZSOUMBLDST-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight (Da) 494.3

Drug properties

Molecular type Small molecule
Endogenous/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 8.52 8.52 8.52 ChEMBL
δ OPRD Human Opioid A pKi 5.7 5.7 5.7 ChEMBL
μ OPRM Human Opioid A pKi 6.86 6.86 6.86 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.3 6.3 6.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pIC50 7.5 7.5 7.5 ChEMBL