CHEMBL112191
SMILES | COc1ccc(CN2CCC(n3c(O)nc4ccccc43)CC2)c(Cl)c1 |
InChIKey | NLFJWBFDRSJFQD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 371.1 |
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 | pIC50 | 5.85 | 5.85 | 5.85 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 6.57 | 6.57 | 6.57 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |