Compound Detail
CHEMBL4850568
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Basic Information
| ChEMBL ID | CHEMBL4850568 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HCVHAEUMOBAINC-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
303.4
MW (Da)
3.61
ALogP
5
HBA
0
HBD
70.2
PSA (Ų)
0.60
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Helicobacter pylori CHEMBL612600 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Helicobacter pylori | IC50 | = | 1100.0 | nM | 5.96 | Antibacterial activity against Helicobacter pylori P12 incubated for 48 hrs by M... | 33234343 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33234343 | 10.1016/j.ejmech.2020.112994 | Helicobacter pylori | 2 |
| 33234343 | 10.1016/j.ejmech.2020.112994 | Clostridium perfringens | 1 |
| 38830427 | 10.1016/j.bmcl.2024.129826 | Clostridium perfringens | 1 |
Data from ChEMBL 36 via Core Engine