CHEMBL101454
SMILES | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 |
InChIKey | KQVCYNWOQKXISA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 0 |
Rotatable bonds | 2 |
Molecular weight (Da) | 326.2 |
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 |
NOP | OPRX | Human | Opioid | A | pKi | 8.85 | 8.86 | 8.86 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.37 | 7.37 | 7.37 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.52 | 7.52 | 7.52 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NOP | OPRX | Human | Opioid | A | pEC50 | 7.68 | 7.69 | 7.7 | ChEMBL |
κ | OPRK | Human | Opioid | A | pEC50 | 6.56 | 6.56 | 6.56 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 7.0 | 7.0 | 7.0 | ChEMBL |