CHEMBL1783826
SMILES | O=C(NCCCN1CCC(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN1Cc1ccccc1 |
InChIKey | UWHDLFOAIARROU-XMMPIXPASA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 473.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Structure pdb | 5DHG |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NOP | OPRX | Mouse | Opioid | A | pKd | 8.0 | 8.0 | 8.0 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pKd | 9.91 | 9.91 | 9.91 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pKi | 9.14 | 9.14 | 9.14 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 6.5 | 6.5 | 6.5 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 6.72 | 6.72 | 6.72 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |