CHEMBL219318
SMILES | C[C@H]1CN2CCN(Cc3ccccc3Cl)C[C@H]2C[C@@]1(C)c1cccc(O)c1 |
InChIKey | NZLFDRJFUHYJKI-XTQVGHSUSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 384.2 |
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 |
δ | OPRD | Human | Opioid | A | pKi | 7.24 | 7.24 | 7.24 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 9.33 | 9.33 | 9.33 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pIC50 | 6.72 | 6.72 | 6.72 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 8.0 | 8.0 | 8.0 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 8.74 | 8.74 | 8.74 | ChEMBL |