Compound Detail
CHEMBL206475
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Basic Information
| ChEMBL ID | CHEMBL206475 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QEKXSCXVUJXAFF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
214.3
MW (Da)
3.48
ALogP
2
HBA
2
HBD
41.8
PSA (Ų)
0.60
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Inosine-5'-monophosphate dehydrogenase 2 CHEMBL2002 | IC50 | 5.63 | 5.63 | 2320.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Inosine-5'-monophosphate dehydrogenase 2 | IC50 | = | 2320.0 | nM | 5.63 | Inhibition of IMPDH2 | 16483769 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16483769 | 10.1016/j.bmcl.2006.01.089 | Inosine-5'-monophosphate dehydrogenase 2 | 1 |
Data from ChEMBL 36 via Core Engine