Compound Detail
CHEMBL1571034
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Basic Information
| ChEMBL ID | CHEMBL1571034 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JUNRINYOIHIGJU-UHFFFAOYSA-N |
6
Targets
8
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
410.4
MW (Da)
3.71
ALogP
8
HBA
3
HBD
118.6
PSA (Ų)
0.34
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 6.14
EC50 2 meas. best 5.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ras and Rab interactor 1/Tyrosine-protein kinase ABL1 CHEMBL3885630 | IC50 | 6.14 | 6.14 | 724.2 | 1 |
| Beta-lactamase CHEMBL1293260 | IC50 | 5.67 | 5.67 | 2126.0 | 1 |
| Beta Lactamase CHEMBL1293246 | IC50 | 5.29 | 5.29 | 5114.0 | 1 |
| Beta-lactamase CHEMBL1293244 | IC50 | 5.25 | 5.25 | 5620.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.15 | 5.15 | 7140.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.07 | 4.97 | 8540.0 | 2 |
| Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 CHEMBL2097170 | IC50 | 4.9 | 4.9 | 12500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine