Compound Detail
CHEMBL27061
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Basic Information
| ChEMBL ID | CHEMBL27061 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KZCFCFDOYOJTOF-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
108.1
MW (Da)
-0.83
ALogP
3
HBA
2
HBD
61.3
PSA (Ų)
0.46
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ornithine decarboxylase CHEMBL3511 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
| T-24 CHEMBL614774 | IC50 | 5.62 | 5.62 | 2380.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ornithine decarboxylase | IC50 | = | 14.0 | nM | 7.85 | Inhibitory activity against Rat liver ornithine decarboxylase (ODC) | 1573631 |
| T-24 | IC50 | = | 2380.0 | nM | 5.62 | Inhibitory activity against Human T24 bladder carcinoma cells | 1573631 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1573631 | 10.1021/jm00086a003 | Ornithine decarboxylase | 1 |
| 1573631 | 10.1021/jm00086a003 | T-24 | 1 |
Data from ChEMBL 36 via Core Engine