CHEMBL4116581
SMILES | Oc1cccc(CCN(CCc2ccccc2)Cc2ccccc2)c1 |
InChIKey | CZDRSHJHLZUQSK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 331.2 |
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 |
δ | OPRD | Human | Opioid | A | pKi | 5.73 | 5.73 | 5.73 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 9.15 | 9.15 | 9.15 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 6.33 | 6.33 | 6.33 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Human | Opioid | A | pEC50 | 8.33 | 8.33 | 8.33 | ChEMBL |