Compound Detail
CHEMBL4471079
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Basic Information
| ChEMBL ID | CHEMBL4471079 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UMSSXPZCCQXFLR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
272.3
MW (Da)
2.85
ALogP
3
HBA
2
HBD
66.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transcription factor SOX-18 CHEMBL4523228 | IC50 | 4.68 | 4.68 | 21000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transcription factor SOX-18 | IC50 | = | 21000.0 | nM | 4.68 | Inhibition of mouse SOX18 expressed in African green monkey COS7 cells assessed ... | - |
Data from ChEMBL 36 via Core Engine