CHEMBL3665444
SMILES | O=c1[nH]c2ccccc2n([C@@H]2C[C@H]3C=C[C@@H](C2)N3C2/C=C\CCCCC2)c1=O |
InChIKey | IQQOBQHEIOGKDI-VNRYDWCLSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 377.2 |
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 |
NOP | OPRX | Human | Opioid | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 4.64 | 4.64 | 4.64 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 4.8 | 4.8 | 4.8 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 6.17 | 6.17 | 6.17 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |