CHEMBL3667565
SMILES | COc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2cccc(C(F)(F)F)c2)cc1 |
InChIKey | YTOXOQFUAILESD-KRWDZBQOSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 428.1 |
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 | 7.26 | 7.26 | 7.26 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 8.05 | 8.05 | 8.05 | ChEMBL |