| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 9EK26WE8QN |
| InChI Key | QLUYMIVVAYRECT-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H20ClNO5 |
| Molecular Weight | 401.85 |
| AlogP | 3.3 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 94.14 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 28.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| INHIBITOR | Cyclin-dependent kinase 1 inhibitor |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDC2 subfamily
|
- | 224 | - | - | - | |
|
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDK9 subfamily
|
- | 20 | - | - | - | |
|
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
|
- | 20 | - | - | - | |
|
Other cytosolic protein
|
- | 20 | - | - | - |
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL3545283 |
| FDA SRS | 9EK26WE8QN |
| PubChem | 24887371 |
| SureChEMBL | SCHEMBL665748 |