CHEMBL2442639
| SMILES | CC(C)CC(=O)OC/C=C\CCNC(=O)/C=C/C=C/C=C/c1cccs1 |
| InChIKey | UXKHBPOYZOPFIH-MKAYIHSVSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 11 |
| Molecular weight (Da) | 373.2 |
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 |
| CB1 | CNR1 | Mouse | Cannabinoid | A | pKi | 5.25 | 5.25 | 5.25 | ChEMBL |
| CB2 | CNR2 | Mouse | Cannabinoid | A | pKi | 4.99 | 4.99 | 4.99 | ChEMBL |
| μ | OPRM | Mouse | Opioid | A | pKi | 4.38 | 4.38 | 4.38 | ChEMBL |
| δ | OPRD | Mouse | Opioid | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |