Compound Detail
CHEMBL593408
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Basic Information
| ChEMBL ID | CHEMBL593408 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IUNYEYCPMAEUHT-MWHLNWJDSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
251.3
MW (Da)
-1.01
ALogP
6
HBA
4
HBD
113.0
PSA (Ų)
0.45
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase CHEMBL5171 | Ki | 4.26 | 4.26 | 55000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase | Ki | = | 55000.0 | nM | 4.26 | Inhibition of Bacillus subtilis LuxS | 19682914 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19682914 | 10.1016/j.bmc.2009.07.057 | S-ribosylhomocysteine lyase | 1 |
Data from ChEMBL 36 via Core Engine