CHEMBL91683
| SMILES | CC(=N)NCCc1ccc2[nH]c3c(c2c1)C[C@@]1(O)C2Cc4ccc(O)c5c4[C@@]1(CCN2CC1CC1)[C@H]3O5 |
| InChIKey | GCVLEFZELCJDJX-JYBLDVITSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 5 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 498.3 |
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 |
| δ | OPRD | Human | Opioid | A | pKi | 7.67 | 7.67 | 7.67 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 9.54 | 9.54 | 9.54 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 7.65 | 7.65 | 7.65 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |