CHEMBL3350136
| SMILES | CN1CC[C@]23c4c5ccc(O)c4O[C@@H]2[C@H](NC(=O)CNC(=O)CNC(=O)CCC(=O)NCC(=O)NCC(=O)N[C@@H]2CC[C@]4(O)[C@H]6Cc7ccc(O)c8c7[C@@]4(CCN6C)[C@@H]2O8)CC[C@]3(O)[C@H]1C5 |
| InChIKey | OTMKLHUGNDKIGO-JVQCECJISA-N |
Chemical properties
| Hydrogen bond acceptors | 14 |
| Hydrogen bond donors | 10 |
| Rotatable bonds | 13 |
| Molecular weight (Da) | 914.4 |
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 |
| κ | OPRK | Guinea pig | Opioid | A | pKi | 7.03 | 7.03 | 7.03 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 7.57 | 7.57 | 7.57 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |