CHEMBL2031506
SMILES | Cc1nc(C(=O)N2[C@@H](C)CCC[C@H]2CNc2ccc(C(F)(F)F)cn2)c(-c2ccc(F)cc2)s1 |
InChIKey | SBWIUDUFVJTASW-LIRRHRJNSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 492.2 |
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 | 7.85 | 7.85 | 7.85 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 7.02 | 7.02 | 7.02 | ChEMBL |