Compound Detail
CHEMBL351568
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Basic Information
| ChEMBL ID | CHEMBL351568 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XYCILAGNHIWZRO-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
386.4
MW (Da)
2.99
ALogP
6
HBA
0
HBD
70.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 4 CHEMBL2094267 | IC50 | 6.75 | 6.375 | 180.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 6.64 | 6.64 | 230.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 4 | IC50 | = | 180.0 | nM | 6.75 | Displacement of [3H]rolipram binding to Phosphodiesterase 4 in rat brain | 1995886 |
| Unchecked | IC50 | = | 230.0 | nM | 6.64 | Inhibition of phosphodiesterase 4 from guinea pig lung | 1995886 |
| Phosphodiesterase 4 | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of phosphodiesterase 4 from rat brain cortex | 1995886 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1995886 | 10.1021/jm00106a024 | Phosphodiesterase 4 | 2 |
| 1995886 | 10.1021/jm00106a024 | Mus musculus | 2 |
| 1995886 | 10.1021/jm00106a024 | Unchecked | 1 |
| 1995886 | 10.1021/jm00106a024 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine