Compound Detail
CHEMBL1232227
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Basic Information
| ChEMBL ID | CHEMBL1232227 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NVRAAJMSMZQKRW-WCTZXXKLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
230.2
MW (Da)
-2.04
ALogP
5
HBA
4
HBD
102.3
PSA (Ų)
0.44
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytidine deaminase CHEMBL2110 | Ki | 5.4 | 5.4 | 4000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytidine deaminase | Ki | = | 4000.0 | nM | 5.4 | Compound was tested for the inhibitory constant for mouse kidney cytidine deamin... | 3735306 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3735306 | 10.1021/jm00158a009 | Cytidine deaminase | 1 |
Data from ChEMBL 36 via Core Engine