Compound Detail
CHEMBL3238349
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Basic Information
| ChEMBL ID | CHEMBL3238349 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IAMLAKVONWARSS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
319.4
MW (Da)
4.01
ALogP
3
HBA
0
HBD
47.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.94
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| ADMET CHEMBL612558 | IC50 | 4.94 | 4.94 | 11490.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| ADMET | IC50 | = | 11490.0 | nM | 4.94 | Cytotoxicity against mouse J774A1 cells assessed as cell viability after 24 hrs ... | 24611928 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24611928 | 10.1021/jm401735w | Mycobacterium tuberculosis | 1 |
| 24611928 | 10.1021/jm401735w | ADMET | 1 |
| 24611928 | 10.1021/jm401735w | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine