CHEMBL3915976
SMILES | O=C1[C@H](O)C[C@@H](c2cccc3c2OCCO3)N1Cc1ccc(OC(F)(F)F)cc1 |
InChIKey | XDKRISIFYVDHAI-JKSUJKDBSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 409.1 |
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 |
OX1 | OX1R | Human | Orexin | A | pIC50 | 5.4 | 5.4 | 5.4 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 5.3 | 5.3 | 5.3 | ChEMBL |