CHEMBL3901710
SMILES | COc1c(Cl)cccc1-c1nnc([C@@H]2CCN2C(=O)c2cc(C)ccc2-n2nccn2)[nH]1 |
InChIKey | DLMMACFCYQEYBV-SFHVURJKSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 449.1 |
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 | 5.14 | 5.14 | 5.14 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pIC50 | 6.77 | 6.77 | 6.77 | ChEMBL |