Trade Names: | |
Synonyms: | |
Status: | Approved (2000) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
ATC: | A10BX03 |
UNII: | 41X3PWK4O2 |
InChI Key | OELFLUMRDSZNSF-BRWVUGGUSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C19H27NO3 |
Molecular Weight | 317.43 |
AlogP | 3.26 |
Hydrogen Bond Acceptor | 2.0 |
Hydrogen Bond Donor | 2.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 66.4 |
Molecular species | ACID |
Aromatic Rings | 1.0 |
Heavy Atoms | 23.0 |
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
|
- | - | - | - | 100 | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC22 family of organic cation and anion transporters
|
- | - | - | 9200 | - |
Resources | Reference |
---|---|
CAS NUMBER | 105816-04-4 |
ChEBI | 31897 |
ChEMBL | CHEMBL783 |
DrugBank | DB00731 |
DrugCentral | 1886 |
EPA CompTox | DTXSID9040687 |
FDA SRS | 41X3PWK4O2 |
Guide to Pharmacology | 6833 |
KEGG | C12508 |
SureChEMBL | SCHEMBL22088 |
ZINC | ZINC000101489663 |