Compound Detail
CHEMBL416815
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL416815 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OGCVAXXJFRWVKM-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
369.4
MW (Da)
4.06
ALogP
5
HBA
1
HBD
73.9
PSA (Ų)
0.78
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 4A CHEMBL3333 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
| cGMP-specific 3',5'-cyclic phosphodiesterase CHEMBL1827 | IC50 | 5.26 | 5.26 | 5500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 4A | IC50 | = | 3000.0 | nM | 5.52 | Inhibitory potency against pig aortic PDE IV | 8201604 |
| cGMP-specific 3',5'-cyclic phosphodiesterase | IC50 | = | 5500.0 | nM | 5.26 | Inhibitory potency against pig aortic PDE V. | 8201604 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8201604 | 10.1021/jm00037a021 | Phosphodiesterase 1 | 1 |
| 8201604 | 10.1021/jm00037a021 | Unchecked | 1 |
| 8201604 | 10.1021/jm00037a021 | Phosphodiesterase 4A | 1 |
| 8201604 | 10.1021/jm00037a021 | cGMP-specific 3',5'-cyclic phosphodiesterase | 1 |
Data from ChEMBL 36 via Core Engine