| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | KWH46ZDG32 |
Structure
| InChI Key | HSHPBORBOJIXSQ-HARLFGEKSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C29H36N6O4S |
| Molecular Weight | 564.71 |
| AlogP | 4.07 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 129.46 |
| Molecular species | BASE |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 40.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Unclassified protein
|
- | 300 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Lymphoma | 1 | D008223 | ClinicalTrials |
Related Entries
MCS
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1446182-94-0 |
| ChEMBL | CHEMBL4297282 |
| DrugBank | DB12336 |
| FDA SRS | KWH46ZDG32 |
| PubChem | 71600094 |
| SureChEMBL | SCHEMBL15088334 |
| ZINC | ZINC000206792055 |
CONTENTS