CHEMBL283480
SMILES | O=C1NCN(c2ccccc2)C12CCN(C1CCc3c(Cl)ccc(Cl)c3C1)CC2 |
InChIKey | GKBLBGBXCLKVGY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 429.1 |
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 |
NOP | OPRX | Human | Opioid | A | pKi | 8.25 | 8.25 | 8.25 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 6.17 | 6.17 | 6.17 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.14 | 8.14 | 8.14 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NOP | OPRX | Human | Opioid | A | pEC50 | 5.82 | 5.82 | 5.82 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 6.51 | 6.51 | 6.51 | ChEMBL |