Compound Detail
CHEMBL3145107
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Basic Information
| ChEMBL ID | CHEMBL3145107 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | USKNSFTWIPDZFI-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
3.44
ALogP
4
HBA
1
HBD
50.7
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 5.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.61 | 5.61 | 2434.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.57 | 5.57 | 2719.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 4.99 | 4.99 | 10284.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.31 | 4.31 | 49067.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptococcus sp. 'group A' | EC50 | = | 2434.0 | nM | 5.61 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptokinase A | EC50 | = | 2719.0 | nM | 5.57 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 10284.0 | nM | 4.99 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
| Unchecked | EC50 | = | 49067.0 | nM | 4.31 | PUBCHEM_BIOASSAY: Screen for small molecule probes relevant to Friedreichs ataxi... | - |
Data from ChEMBL 36 via Core Engine