CHEMBL1834902
SMILES | Oc1ccc2c3c1O[C@H]1[C@](O)([C@@H]4N=C[C@@]5(CC[C@@]6(O)[C@H]7Cc8ccc(O)c9c8[C@@]6(CCN7CC6CC6)[C@H]5O9)O4)CC[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314 |
InChIKey | ASLJLOBODNWHRX-TVATVUHRSA-N |
Chemical properties
Hydrogen bond acceptors | 11 |
Hydrogen bond donors | 5 |
Rotatable bonds | 5 |
Molecular weight (Da) | 723.4 |
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 |
μ | OPRM | Mouse | Opioid | A | pKi | 8.99 | 8.99 | 8.99 | ChEMBL |
δ | OPRD | Mouse | Opioid | A | pKi | 7.4 | 7.4 | 7.4 | ChEMBL |
κ | OPRK | Guinea pig | Opioid | A | pKi | 8.78 | 8.78 | 8.78 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |