CHEMBL4439811
SMILES | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(/C=N/O)c4ccccc43)CC2)CC1 |
InChIKey | KXDZSADJKWDKCN-ATIASUJISA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 367.3 |
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 |
NOP | OPRX | Human | Opioid | A | pKi | 8.66 | 8.66 | 8.66 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 5.77 | 5.77 | 5.77 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NOP | OPRX | Human | Opioid | A | pEC50 | 7.17 | 7.17 | 7.17 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 5.5 | 5.5 | 5.5 | ChEMBL |