Compound Detail
CHEMBL432717
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Basic Information
| ChEMBL ID | CHEMBL432717 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XYUOWTGQHOUXIO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
2.08
ALogP
4
HBA
2
HBD
75.1
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 3 CHEMBL2094125 | IC50 | 6.9 | 6.9 | 125.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 3 | IC50 | = | 125.89 | nM | 6.9 | Inhibition of dual cGMP-inhibited phosphodiesterase 3 (PDE3) was determined in h... | 12723963 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3031290 | 10.1021/jm00387a007 | Canis familiaris | 3 |
| 12723963 | 10.1021/jm030776l | Phosphodiesterase 3 | 1 |
Data from ChEMBL 36 via Core Engine