CHEMBL396637
SMILES | CC(C)(C)CCN1CCCc2cc(Oc3ccc(C(N)=O)cn3)ccc2C1 |
InChIKey | APGOIOSHPGLHQN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 367.2 |
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 |
δ | OPRD | Human | Opioid | A | pKi | 6.39 | 6.39 | 6.39 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.14 | 7.14 | 7.14 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.74 | 7.74 | 7.74 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.74 | 7.74 | 7.74 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 6.39 | 6.39 | 6.39 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 7.14 | 7.14 | 7.14 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |