CHEMBL3904615
SMILES | COc1cc(C(=O)N2CC[C@H]2c2noc(-c3cccc(Cl)c3C)n2)c(-c2ncccn2)cc1C |
InChIKey | PMPLHHCEDONMDL-FQEVSTJZSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 475.1 |
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 | 6.25 | 6.25 | 6.25 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 8.3 | 8.3 | 8.3 | ChEMBL |