| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 980M4N37DH |
Structure
| InChI Key | ZXBFYBLSJMEBEP-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H20BrN5O2 |
| Molecular Weight | 466.34 |
| AlogP | 5.08 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 94.2 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 4.0 |
| Heavy Atoms | 30.0 |
Pharmacology
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Ovarian Neoplasms | 1 | D010051 | ClinicalTrials |
| Colonic Neoplasms | 1 | D003110 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 900573-88-8 |
| ChEMBL | CHEMBL3545155 |
| DrugBank | DB12744 |
| FDA SRS | 980M4N37DH |
| PubChem | 11691242 |
| SureChEMBL | SCHEMBL5585996 |
| ZINC | ZINC000038255464 |
CONTENTS