CHEMBL288178
SMILES | C=C(Cl)C(=O)N[C@@]12CCC(=O)[C@@H]3Oc4c(O)ccc5c4C31CCN(CC1CC1)C2C5 |
InChIKey | MVSBLZZXOLNTIU-NGCYQRTHSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 428.2 |
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 |
μ | OPRM | Bovine | Opioid | A | pIC50 | 7.63 | 7.63 | 7.63 | ChEMBL |
δ | OPRD | Human | Opioid | A | pIC50 | 6.75 | 6.75 | 6.75 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 6.3 | 6.3 | 6.3 | ChEMBL |