Compound Detail
CHEMBL307547
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Basic Information
| ChEMBL ID | CHEMBL307547 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MAGHWGVDYNCOSV-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
348.4
MW (Da)
3.26
ALogP
8
HBA
2
HBD
104.0
PSA (Ų)
0.57
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Inosine-5'-monophosphate dehydrogenase 2 CHEMBL2002 | IC50 | 6.82 | 6.82 | 150.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Inosine-5'-monophosphate dehydrogenase 2 | IC50 | = | 150.0 | nM | 6.82 | Inhibition of Inosine Monophosphate Dehydrogenase II (IMPDH II) | 12372516 |
| Inosine-5'-monophosphate dehydrogenase 2 | IC50 | = | 150.0 | nM | 6.82 | Inhibition of human Inosine-5'-monophosphate dehydrogenase 2 | 12127522 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12372516 | 10.1016/s0960-894x(02)00641-8 | Inosine-5'-monophosphate dehydrogenase 2 | 1 |
| 12127522 | 10.1016/s0960-894x(02)00351-7 | Inosine-5'-monophosphate dehydrogenase 2 | 1 |
| 12127522 | 10.1016/s0960-894x(02)00351-7 | CCRF-CEM | 1 |
Data from ChEMBL 36 via Core Engine