CHEMBL127814
SMILES | COc1ccc(C[C@H]2CN3C(=NC[C@@H]3C)N2C(C)C23CC4CC(CC(C4)C2)C3)cc1 |
InChIKey | LSRPJNTWHNCYBF-NGQJCHFRSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 407.3 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Guinea pig | Opioid | A | pIC50 | 5.43 | 5.43 | 5.43 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 5.82 | 5.82 | 5.82 | ChEMBL |