Compound Detail
CHEMBL1364493
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Basic Information
| ChEMBL ID | CHEMBL1364493 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DUWCNYMPNAVXRW-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
389.4
MW (Da)
3.50
ALogP
6
HBA
1
HBD
94.0
PSA (Ų)
0.42
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Calpain-2 catalytic subunit CHEMBL4143 | IC50 | 6.04 | 6.04 | 910.0 | 1 |
| H9c2 CHEMBL614576 | IC50 | 4.56 | 4.56 | 27333.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Calpain-2 catalytic subunit | IC50 | = | 909.97 | nM | 6.04 | PUBCHEM_BIOASSAY: Dose Response Confirmation for Calpain Inhibitors. (Class of a... | - |
| H9c2 | IC50 | = | 27333.0 | nM | 4.56 | PUBCHEM_BIOASSAY: Dose response confirmation of uHTS hits for small molecule mod... | - |
Data from ChEMBL 36 via Core Engine