Compound Detail
CHEMBL66522
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Basic Information
| ChEMBL ID | CHEMBL66522 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IASFSCWLFJGXQL-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
294.1
MW (Da)
2.08
ALogP
3
HBA
1
HBD
44.7
PSA (Ų)
0.80
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 3 CHEMBL2094125 | IC50 | 7.16 | 7.16 | 70.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 3 | IC50 | = | 70.0 | nM | 7.16 | Inhibition of platelet cAMP phosphodiesterase | 2846839 |
| Phosphodiesterase 3 | IC50 | = | 70.0 | nM | 7.16 | Inhibition of human recombinant PDE3 expressed in Escherichia coli | 37077378 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2846839 | 10.1021/jm00119a014 | Phosphodiesterase 3 | 1 |
| 37077378 | 10.1021/acsmedchemlett.3c00092 | Phosphodiesterase 3 | 1 |
Data from ChEMBL 36 via Core Engine