| Synonyms: | |
| Status: | Approved (2014) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | A16AX10 |
| UNII: | DR40J4WA67 |
Structure
| InChI Key | FJZZPCZKBUKGGU-AUSIDOKSSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C23H36N2O4 |
| Molecular Weight | 404.55 |
| AlogP | 3.43 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 71.03 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 29.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | 16 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Gaucher Disease | 3 | D005776 | ClinicalTrials |
| Gaucher Disease | 3 | D005776 | ClinicalTrials |
| Gaucher Disease | 3 | D005776 | ClinicalTrials |
| Hematologic Neoplasms | 1 | D019337 | ClinicalTrials |
Related Entries
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 491833-29-5 |
| ChEBI | 82752 |
| ChEMBL | CHEMBL2110588 |
| DrugBank | DB09039 |
| DrugCentral | 4834 |
| FDA SRS | DR40J4WA67 |
| Guide to Pharmacology | 7536 |
| PharmGKB | PA166123486 |
| PubChem | 23652731 |
| SureChEMBL | SCHEMBL421755 |
| ZINC | ZINC000072267023 |
CONTENTS