CHEMBL3917258
SMILES | COc1cccc(OC(C)C)c1C1CCCC(=O)N1Cc1ccc(OC(F)(F)F)cc1 |
InChIKey | BQJGXKNFCKZUTE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 437.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
OX1 | OX1R | Human | Orexin | A | pIC50 | 6.44 | 6.44 | 6.44 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 7.07 | 7.07 | 7.07 | ChEMBL |