Compound Detail
CHEMBL4159571
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 | CHEMBL4159571 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FBDASCMVNLCAQQ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
338.4
MW (Da)
5.24
ALogP
2
HBA
0
HBD
18.5
PSA (Ų)
0.65
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Chlamydia trachomatis CHEMBL614606 | IC50 | 4.63 | 4.63 | 23388.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Chlamydia trachomatis | IC50 | = | 23388.37 | nM | 4.63 | Antichlamydial activity against Chlamydia trachomatis serovar L2 454/Bu infected... | 29232584 |
| Chlamydia trachomatis | IC50 | = | 23400.0 | nM | 4.63 | Antichlamydial activity against Chlamydia trachomatis serovar L2 454/Bu infected... | 29232584 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29232584 | 10.1016/j.ejmech.2017.11.099 | Unchecked | 4 |
| 29232584 | 10.1016/j.ejmech.2017.11.099 | Chlamydia trachomatis | 2 |
Data from ChEMBL 36 via Core Engine