CHEMBL2413514
SMILES | Cc1noc(-c2ccccc2CN2CCCC3(CCN(c4cnc5ccccc5n4)CC3)C2=O)n1 |
InChIKey | ORQIXYIDXFFJOU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 468.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
OX1 | OX1R | Human | Orexin | A | pKi | 5.85 | 5.85 | 5.85 | ChEMBL |
OX1 | OX1R | Human | Orexin | A | pKd | 5.56 | 5.56 | 5.56 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pKi | 7.6 | 7.6 | 7.6 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pKd | 6.61 | 6.61 | 6.61 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |