Compound Detail
CHEMBL1795456
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Basic Information
| ChEMBL ID | CHEMBL1795456 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TVKDHXNQPJFOJY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
510.6
MW (Da)
6.14
ALogP
6
HBA
1
HBD
74.2
PSA (Ų)
0.23
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hypoxia-inducible factor 1-alpha CHEMBL4261 | IC50 | 5.58 | 5.58 | 2600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hypoxia-inducible factor 1-alpha | IC50 | = | 2600.0 | nM | 5.58 | Inhibition of hypoxia-induced HIF1alpha activation in human Hep3B cells after 16... | 21481991 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21481991 | 10.1016/j.ejmech.2011.03.022 | ADMET | 1 |
| 21481991 | 10.1016/j.ejmech.2011.03.022 | Hypoxia-inducible factor 1-alpha | 1 |
Data from ChEMBL 36 via Core Engine