CHEMBL3902957
SMILES | O=C(c1cc(F)ccc1-n1nccn1)N1CCOC1Cn1ccc(-c2ccc(F)cn2)n1 |
InChIKey | LWIJBIHKOCBNNV-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 437.1 |
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 | 6.92 | 7.31 | 7.71 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 6.6 | 6.68 | 6.77 | ChEMBL |