CHEMBL138101
SMILES | COc1cc2c(cc1OC)CN(C(=O)C(Cc1ccc(Br)cc1)C(C)(C)C)CC2 |
InChIKey | UHAYOUSNUNIKHN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 459.1 |
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 | 5.16 | 5.16 | 5.16 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 5.7 | 5.7 | 5.7 | ChEMBL |