CHEMBL1197249
SMILES | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 |
InChIKey | DTAPURRKADLRKH-YHELAOLJSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 425.3 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Human | Opioid | A | pIC50 | 5.17 | 5.17 | 5.17 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 5.57 | 5.57 | 5.57 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pIC50 | 7.54 | 8.13 | 8.72 | ChEMBL |