| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | E3T5XXY9HX |
Structure
| InChI Key | KBQCEQAXHPIRTF-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C35H34ClN5O3S2 |
| Molecular Weight | 672.28 |
| AlogP | 8.18 |
| Hydrogen Bond Acceptor | 9.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 87.1 |
| Molecular species | ACID |
| Aromatic Rings | 6.0 |
| Heavy Atoms | 46.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Other cytosolic protein
|
- | - | - | 0-0 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Leukemia, Myeloid, Acute | 1 | D015470 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL4297482 |
| DrugBank | DB14792 |
| FDA SRS | E3T5XXY9HX |
| PDB | E4W |
| PubChem | 131634760 |
| SureChEMBL | SCHEMBL19472011 |
CONTENTS