Compound Detail
CHEMBL262063
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Basic Information
| ChEMBL ID | CHEMBL262063 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | REGXGANNNMTWAW-ZQNVIIHSSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
277.3
MW (Da)
-1.15
ALogP
8
HBA
4
HBD
130.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosylhomocysteinase CHEMBL6076 | IC50 | 5.68 | 5.68 | 2100.0 | 1 |
| Adenosylhomocysteinase CHEMBL2664 | IC50 | 4.8 | 4.8 | 15700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosylhomocysteinase | IC50 | = | 2100.0 | nM | 5.68 | Inhibition of Plasmodium falciparum SAHH | 18295495 |
| Adenosylhomocysteinase | IC50 | = | 15700.0 | nM | 4.8 | Inhibition of human SAHH | 18295495 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18295495 | 10.1016/j.bmc.2008.01.046 | Adenosylhomocysteinase | 2 |
| 18295495 | 10.1016/j.bmc.2008.01.046 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine