CHEMBL238317
SMILES | NC(=O)c1ccc(Oc2ccc(CNCCc3ccccc3)cc2)cc1 |
InChIKey | FARQYUHOSNLRKV-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 346.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pKi | 8.73 | 8.88 | 9.04 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.82 | 8.37 | 8.91 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 9.54 | 9.68 | 9.82 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 8.73 | 8.88 | 9.04 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 7.82 | 8.37 | 8.91 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 9.54 | 9.68 | 9.82 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |