CHEMBL473278
SMILES | CC1(C)CCC(N2CCC3(CC2)C(=O)N(CCNCC2CC2)CN3c2ccccc2)c2ccccc21 |
InChIKey | LQMOLTNLIVUBMU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 486.3 |
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 |
κ | OPRK | Human | Opioid | A | pKi | 6.76 | 6.76 | 6.76 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 6.62 | 6.62 | 6.62 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pKi | 9.1 | 9.1 | 9.1 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 5.54 | 5.54 | 5.54 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 6.62 | 6.62 | 6.62 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 6.76 | 6.76 | 6.76 | PDSP Ki database |
NOP | OPRX | Human | Opioid | A | pKi | 9.1 | 9.1 | 9.1 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |