CHEMBL240215
SMILES | O=C1NCN(c2ccccc2)C12CCN(Cc1c(Cl)cccc1Cl)CC2 |
InChIKey | KEDOVCNKPNVSAY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 389.1 |
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 | 8.64 | 8.64 | 8.64 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 5.79 | 5.79 | 5.79 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.53 | 7.54 | 7.54 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pKi | 8.64 | 8.64 | 8.64 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 7.28 | 7.28 | 7.28 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 7.54 | 7.54 | 7.54 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 5.79 | 5.79 | 5.79 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |