CHEMBL290543


SMILES CN(C(=O)Cc1ccc(Cl)c(Cl)c1)C1CCCCC1N1CCCC1
InChIKey VQLPLYSROCPWFF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 368.1

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
κ OPRK Rat Opioid A pKi 9.22 9.29 9.35 ChEMBL
κ OPRK Mouse Opioid A pKi 8.09 8.09 8.09 ChEMBL
δ OPRD Rat Opioid A pKi 5.09 5.09 5.09 ChEMBL
κ OPRK Guinea pig Opioid A pKi 5.89 8.62 9.57 ChEMBL
μ OPRM Rat Opioid A pKi 5.67 5.86 6.14 ChEMBL
δ OPRD Human Opioid A pKi 4.68 5.29 5.6 ChEMBL
κ OPRK Human Opioid A pKi 6.92 8.76 10.03 ChEMBL
μ OPRM Human Opioid A pKi 6.08 6.35 6.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Rat Opioid A pIC50 9.17 9.18 9.19 ChEMBL
κ OPRK Mouse Opioid A pIC50 8.27 8.65 8.9 ChEMBL
κ OPRK Mouse Opioid A pEC50 5.31 7.38 8.77 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.75 4.83 5.0 ChEMBL
κ OPRK Guinea pig Opioid A pIC50 7.02 8.29 9.52 ChEMBL
μ OPRM Rat Opioid A pIC50 9.0 9.0 9.0 ChEMBL
κ OPRK Human Opioid A pEC50 6.2 7.91 9.4 ChEMBL
κ OPRK Human Opioid A pIC50 6.43 8.72 9.52 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 4.7 5.03 5.2 ChEMBL
μ OPRM Human Opioid A pEC50 5.32 5.32 5.32 ChEMBL