| Synonyms: | |
| Status: | Approved (1960) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 4VFX2L7EM5 |
Structure
| InChI Key | RETIMRUQNCDCQB-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value | |
|---|---|---|
| Molecular Formula | C15H23ClN2O | |
| Molecular Weight | 282.82 | |
| AlogP | 2.73 | |
| Hydrogen Bond Acceptor | 2.0 | |
| Hydrogen Bond Donor | 1.0 | |
| Number of Rotational Bond | 2.0 | |
| Polar Surface Area | 32.34 | |
| Molecular species | NEUTRAL | |
| Aromatic Rings | 1.0 | |
| Heavy Atoms | 18.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | ||
|---|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 96 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 6760 |
| ChEMBL | CHEMBL1200440 |
| EPA CompTox | DTXSID4031566 |
| FDA SRS | 4VFX2L7EM5 |
| SureChEMBL | SCHEMBL34245 |
CONTENTS