CHEMBL284414
SMILES | O=C1NCN(c2ccccc2)C12CCN(C1CCc3ccccc31)CC2 |
InChIKey | FQJXOOHCZZQVHD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 347.2 |
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 | 8.92 | 9.04 | 9.15 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 5.73 | 6.0 | 6.27 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.5 | 7.89 | 8.28 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.72 | 8.1 | 8.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NOP | OPRX | Human | Opioid | A | pEC50 | 5.1 | 5.1 | 5.1 | ChEMBL |