Compound Detail
CHEMBL1504429
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Basic Information
| ChEMBL ID | CHEMBL1504429 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JVJXCUAWYNIAOL-UHFFFAOYSA-N |
6
Targets
9
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
445.5
MW (Da)
4.26
ALogP
11
HBA
1
HBD
133.3
PSA (Ų)
0.18
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 5.86
IC50 4 meas. best 5.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.86 | 5.59 | 1377.0 | 2 |
| Type-1 angiotensin II receptor CHEMBL227 | IC50 | 5.69 | 5.69 | 2057.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.62 | 5.62 | 2429.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.49 | 5.49 | 3262.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.43 | 5.43 | 3700.0 | 1 |
| Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase CHEMBL1741212 | IC50 | 5.41 | 5.12 | 3920.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 5.11 | 5.11 | 7736.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine