CHEMBL240074


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

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 10
Molecular weight (Da) 497.3

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
NOP OPRX Human Opioid A pKi 9.0 9.0 9.0 ChEMBL
κ OPRK Guinea pig Opioid A pKi 7.0 7.0 7.0 ChEMBL
δ OPRD Human Opioid A pKi 6.22 6.22 6.22 ChEMBL
μ OPRM Human Opioid A pKi 7.64 7.64 7.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pIC50 7.48 7.48 7.48 ChEMBL