CHEMBL5416582


SMILES CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN4CCCC4)cc4ccccc43)CC2)CC1
InChIKey NJWKUHYGAJDRKS-QUPDYRNUSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 407.3

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 8.94 8.94 8.94 ChEMBL
δ OPRD Human Opioid A pKi 6.93 6.93 6.93 ChEMBL
κ OPRK Human Opioid A pKi 7.51 7.51 7.51 ChEMBL
μ OPRM Human Opioid A pKi 9.24 9.24 9.24 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.14 8.14 8.14 ChEMBL
δ OPRD Human Opioid A pEC50 6.03 6.03 6.03 ChEMBL
μ OPRM Human Opioid A pEC50 7.4 7.4 7.4 ChEMBL