Compound Detail
CHEMBL593446
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL593446 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IQFWYNFDWRYSRA-BLELIYKESA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
267.3
MW (Da)
-2.04
ALogP
7
HBA
5
HBD
133.2
PSA (Ų)
0.35
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase CHEMBL5171 | Ki | 6.37 | 5.875 | 430.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| S-ribosylhomocysteine lyase | Ki | = | 430.0 | nM | 6.37 | Inhibition of Bacillus subtilis LuxS assessed as enzyme-inhibitor dissociation c... | 19682914 |
| S-ribosylhomocysteine lyase | Ki | = | 4200.0 | nM | 5.38 | Inhibition of Bacillus subtilis LuxS | 19682914 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19682914 | 10.1016/j.bmc.2009.07.057 | S-ribosylhomocysteine lyase | 3 |
Data from ChEMBL 36 via Core Engine