Compound Detail
CHEMBL1973532
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Basic Information
| ChEMBL ID | CHEMBL1973532 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HTYOLSXFGOVOTC-YDZHTSKRSA-N |
5
Targets
5
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
425.8
MW (Da)
3.34
ALogP
6
HBA
3
HBD
125.1
PSA (Ų)
0.32
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 5.47
IC50 1 meas. best 4.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptokinase A CHEMBL1293228 | EC50 | 5.47 | 5.47 | 3381.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.42 | 5.42 | 3802.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.14 | 5.14 | 7212.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.49 | 4.49 | 32479.0 | 1 |
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 4.39 | 4.39 | 40229.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptokinase A | EC50 | = | 3381.0 | nM | 5.47 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus sp. 'group A' | EC50 | = | 3802.0 | nM | 5.42 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 7212.0 | nM | 5.14 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
| Unchecked | IC50 | = | 32479.0 | nM | 4.49 | PubChem BioAssay. QFRET-based biochemical high throughput dose response assay to... | - |
| Zinc finger protein mex-5 | EC50 | = | 40229.0 | nM | 4.39 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
Data from ChEMBL 36 via Core Engine