Compound Detail
CHEMBL458328
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 | CHEMBL458328 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MGLDCXPLYOWQRP-UHFFFAOYSA-N |
12
Targets
24
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
296.4
MW (Da)
4.01
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 24 meas. best 6.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 6.36 | 6.36 | 441.5 | 1 |
| Dual specificity protein phosphatase 6 CHEMBL5511 | IC50 | 6.08 | 5.0667 | 832.0 | 3 |
| Candida albicans CHEMBL366 | IC50 | 5.77 | 5.4425 | 1700.0 | 8 |
| Trichophyton rubrum CHEMBL612649 | IC50 | 5.54 | 5.31 | 2900.0 | 2 |
| Candida parapsilosis CHEMBL612868 | IC50 | 5.27 | 5.27 | 5400.0 | 1 |
| Trichophyton mentagrophytes CHEMBL613162 | IC50 | 5.17 | 5.01 | 6700.0 | 2 |
| Aspergillus fumigatus CHEMBL363 | IC50 | 5.0 | 4.94 | 10000.0 | 2 |
| Envelope glycoprotein gp160 CHEMBL1293311 | IC50 | 4.92 | 4.92 | 11900.0 | 1 |
| Tyrosine-protein phosphatase non-receptor type 7 CHEMBL2219 | IC50 | 4.81 | 4.81 | 15400.0 | 1 |
| Candida tropicalis CHEMBL612870 | IC50 | 4.56 | 4.56 | 27700.0 | 1 |
| Genome polyprotein CHEMBL1293305 | IC50 | 4.33 | 4.33 | 46301.0 | 1 |
| Aspergillus niger CHEMBL358 | IC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine