J-113397


SMILES OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1
InChIKey MBGVUMXBUGIIBQ-LEWJYISDSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 399.3

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 8.64 9.02 9.39 ChEMBL
NOP OPRX Human Opioid A pKi 8.7 8.7 8.7 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pIC50 8.25 8.59 8.82 ChEMBL
κ OPRK Human Opioid A pIC50 5.8 5.82 5.85 ChEMBL
μ OPRM Human Opioid A pIC50 5.47 5.56 5.66 ChEMBL
NOP OPRX Human Opioid A pIC50 8.3 8.3 8.3 Guide to Pharmacology