Compound Detail
CHEMBL184045
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Basic Information
| ChEMBL ID | CHEMBL184045 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KZEYCXFHJYQOQW-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1206046 |
| Active Moiety | CHEMBL1206046 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
248.3
MW (Da)
2.56
ALogP
3
HBA
1
HBD
63.6
PSA (Ų)
0.37
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.12 | 5.12 | 7500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 7500.0 | nM | 5.12 | Inhibitory activity against 20-Hydroxy-5,8,11,14-eicosatetraenoic acid synthase ... | 15454216 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15454216 | 10.1016/j.bmcl.2004.08.025 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine