CHEMBL4065444 [312226]
CHEMBL4065444
| SMILES | O=C(c1csc(-c2cccc(Cl)c2Cl)n1)N1CCOCC1 |
| InChIKey | IBAXTMXGXUKMSM-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 2 |
| Log P | 3.589 |
| Molecular weight (Da) | 342.0 |
| Stereochemistry info | unspecified |
Database connections
| Ligand site mutations | 5-HT2C |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
CHEMBL4065444
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Database connections
| Ligand site mutations | 5-HT2C |