CHEMBL115652
SMILES | O=C1NCN(c2ccccc2)C12CCN(Cc1cc3c(cc1Cl)OCO3)CC2 |
InChIKey | QATNQFJQXRFOHL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 399.1 |
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 |
NOP | OPRX | Human | Opioid | A | pIC50 | 7.01 | 7.01 | 7.01 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pIC50 | 5.67 | 5.67 | 5.67 | ChEMBL |
δ | OPRD | Human | Opioid | A | pIC50 | 6.86 | 6.86 | 6.86 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 8.24 | 8.24 | 8.24 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 8.7 | 8.7 | 8.7 | ChEMBL |