CHEMBL3922456
SMILES | Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H]3COc2ccccn2)c(-c2ccccc2)n1 |
InChIKey | YVPZCTKMAKXJOL-NSHGMRRFSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 388.2 |
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 |
OX1 | OX1R | Rat | Orexin | A | pKi | 6.38 | 6.38 | 6.38 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pKi | 5.51 | 5.51 | 5.51 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |