CHEMBL407685
SMILES | C=C(COc1ccc2c3c1O[C@H]1c4[nH]c5c(c4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314)C[C@@]1(O)[C@H]2Cc3ccc(OCC(=C)C(=O)OC)c4c3[C@@]1(CCN2CC1CC1)[C@H]5O4)C(=O)OC |
InChIKey | OENOSKJZARWWAW-GULDIMLMSA-N |
Chemical properties
Hydrogen bond acceptors | 12 |
Hydrogen bond donors | 3 |
Rotatable bonds | 12 |
Molecular weight (Da) | 857.4 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Guinea pig | Opioid | A | pIC50 | 8.08 | 8.08 | 8.08 | ChEMBL |
δ | OPRD | Human | Opioid | A | pIC50 | 7.3 | 7.3 | 7.3 | ChEMBL |