Compound Detail
CHEMBL1076756
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Basic Information
| ChEMBL ID | CHEMBL1076756 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HAMFEFSJOFWARR-MKICQXMISA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
287.4
MW (Da)
3.45
ALogP
4
HBA
1
HBD
29.1
PSA (Ų)
0.86
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21514701 | 10.1016/j.ejmech.2011.03.060 | NCI-H460 | 3 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | MCF7 | 3 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | SF-268 | 3 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | Rattus norvegicus | 2 |
| 19969398 | 10.1016/j.ejmech.2009.11.041 | SK-OV-3 | 1 |
| 19969398 | 10.1016/j.ejmech.2009.11.041 | NON-PROTEIN TARGET | 1 |
| 19969398 | 10.1016/j.ejmech.2009.11.041 | A549 | 1 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | No relevant target | 1 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | Unchecked | 1 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | Aldo-keto reductase family 1 member B1 | 1 |
| 21514701 | 10.1016/j.ejmech.2011.03.060 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine