Compound Detail
CHEMBL383729
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Basic Information
| ChEMBL ID | CHEMBL383729 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KLHVYBSLQDFBBT-HXUQBWEZSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
253.3
MW (Da)
-2.43
ALogP
7
HBA
5
HBD
133.2
PSA (Ų)
0.37
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase CHEMBL5171 | Ki | 4.16 | 4.16 | 70000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase | Ki | = | 70000.0 | nM | 4.16 | Inhibition of cobalt substituted Bacillus subtilis LuxS | 16686542 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16686542 | 10.1021/jm060047g | S-ribosylhomocysteine lyase | 1 |
Data from ChEMBL 36 via Core Engine