CHEMBL1197240
| SMILES | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 |
| InChIKey | IRPKXQKVWDRXTK-UEXGIBASSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 425.3 |
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 | 7.82 | 8.23 | 8.64 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pIC50 | 4.96 | 4.96 | 4.96 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 5.21 | 5.21 | 5.21 | ChEMBL |