CHEMBL238305
SMILES | CC(C)NC(=O)c1ccc(Oc2ccc(CNCCc3ccccc3)cc2)nc1 |
InChIKey | ATDZZSMIODIYKR-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 389.2 |
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 | 5.62 | 5.62 | 5.62 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 5.62 | 5.62 | 5.62 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 5.3 | 5.3 | 5.3 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 7.28 | 7.28 | 7.28 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |