Compound Detail
CHEMBL4641278
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 | CHEMBL4641278 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RAWZQAJAGNFDSN-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
427.9
MW (Da)
5.02
ALogP
6
HBA
2
HBD
84.2
PSA (Ų)
0.47
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptococcus pneumoniae CHEMBL347 | IC50 | 6.42 | 6.2 | 380.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptococcus pneumoniae | IC50 | = | 380.0 | nM | 6.42 | Antibacterial activity against Streptococcus pneumoniae ATCC 700904 | 32146051 |
| Streptococcus pneumoniae | IC50 | = | 660.0 | nM | 6.18 | Antibacterial activity against Streptococcus pneumoniae ATCC BAA1663 | 32146051 |
| Streptococcus pneumoniae | IC50 | = | 1000.0 | nM | 6.0 | Antibacterial activity against Streptococcus pneumoniae ATCC 49617 | 32146051 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32146051 | 10.1016/j.bmcl.2020.127071 | Streptococcus pneumoniae | 3 |
Data from ChEMBL 36 via Core Engine