Compound Detail
CHEMBL1558214
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Basic Information
| ChEMBL ID | CHEMBL1558214 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TYGSJGGFTPJZMM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
3.45
ALogP
4
HBA
0
HBD
42.0
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.77 | 4.77 | 17000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 17000.0 | nM | 4.77 | Inhibition of bovine aortic PDE4 using cAMP as substrate in presence of cGMP | 21920746 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21920746 | 10.1016/j.bmcl.2011.08.036 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine