CHEMBL3921425
SMILES | COc1ccc2c(c1C1CCCC(=O)N1Cc1cccc(-c3ncc(C)s3)c1)OCCO2 |
InChIKey | RTMNZHDFLIRHSP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 450.2 |
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 | 8.15 | 8.15 | 8.15 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 8.1 | 8.1 | 8.1 | ChEMBL |