CHEMBL4070288
SMILES | CCc1ccc(C(=O)NCC2c3ccccc3CCN2C)cc1 |
InChIKey | RGAQWGCPPCLXIL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 308.2 |
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 |
μ | OPRM | Human | Opioid | A | pKi | 8.64 | 8.64 | 8.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pIC50 | 6.72 | 6.72 | 6.72 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 6.31 | 6.31 | 6.31 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 8.0 | 8.0 | 8.0 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 5.48 | 5.48 | 5.48 | ChEMBL |