Compound Detail
CHEMBL1495778
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Basic Information
| ChEMBL ID | CHEMBL1495778 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RSYMXQPQWJUWGI-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
303.1
MW (Da)
3.50
ALogP
3
HBA
0
HBD
47.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.72 | 5.72 | 1918.8 | 1 |
| Bifunctional protein GlmU CHEMBL1293297 | IC50 | 4.73 | 4.73 | 18470.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 | IC50 | = | 1918.82 | nM | 5.72 | PUBCHEM_BIOASSAY: Dose Response Confirmation for Mcl-1/Noxa Interaction Inhibito... | - |
| Bifunctional protein GlmU | IC50 | = | 18470.0 | nM | 4.73 | PUBCHEM_BIOASSAY: Inhibitors of Mycobacterial Glucosamine-1-phosphate acetyl tra... | - |
Data from ChEMBL 36 via Core Engine