CHEMBL3393991
SMILES | O=C(Nc1nc2ccccc2n1CCN1CCCC1)c1ccc(Cl)c(Cl)c1 |
InChIKey | GMCVIBDVLCHMNN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 402.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pEC50 | 5.77 | 5.77 | 5.77 | ChEMBL |
κ | OPRK | Human | Opioid | A | pEC50 | 8.15 | 8.15 | 8.15 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 5.75 | 5.75 | 5.75 | ChEMBL |