Compound Detail
CHEMBL374469
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Basic Information
| ChEMBL ID | CHEMBL374469 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LXEWAHUCHFYGPZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
286.3
MW (Da)
-0.03
ALogP
5
HBA
3
HBD
96.2
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Guanine deaminase CHEMBL3129 | Ki | 4.7 | 4.7 | 20100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Guanine deaminase | Ki | = | 20100.0 | nM | 4.7 | Inhibition of rabbit liver guanase | 16920357 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16920357 | 10.1016/j.bmcl.2006.08.033 | Guanine deaminase | 1 |
Data from ChEMBL 36 via Core Engine