Compound Detail
CHEMBL1372231
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Basic Information
| ChEMBL ID | CHEMBL1372231 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MDIUHSXLUNWCLE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
438.6
MW (Da)
5.08
ALogP
7
HBA
1
HBD
84.8
PSA (Ų)
0.42
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Runt-related transcription factor 1/Core-binding factor subunit beta CHEMBL2093862 | IC50 | 6.15 | 5.975 | 713.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Runt-related transcription factor 1/Core-binding factor subunit beta | IC50 | = | 713.43 | nM | 6.15 | PUBCHEM_BIOASSAY: Confirmation of compounds inhibiting the binding between the R... | - |
| Runt-related transcription factor 1/Core-binding factor subunit beta | IC50 | = | 1600.0 | nM | 5.8 | PUBCHEM_BIOASSAY: uHTS identification of compounds inhibiting the binding betwee... | - |
Data from ChEMBL 36 via Core Engine