CHEMBL2017142
SMILES | CN(C(=O)/C=C/c1ccoc1)[C@H]1CCC23Cc4ccc(O)cc4C2(CCN(CC2CC2)C3)C1 |
InChIKey | MLGNFOAOQAXJRD-BPCOBWGCSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 446.3 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 | 7.46 | 8.06 | 8.66 | ChEMBL |
κ | OPRK | Guinea pig | Opioid | A | pKi | 9.08 | 9.08 | 9.08 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |