Compound Detail
CHEMBL1525098
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Basic Information
| ChEMBL ID | CHEMBL1525098 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PSCATEPWKBMJOU-UHFFFAOYSA-N |
4
Targets
7
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
393.2
MW (Da)
5.48
ALogP
3
HBA
3
HBD
73.1
PSA (Ų)
0.23
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 7 meas. best 7.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 7.13 | 7.13 | 74.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 6.94 | 6.94 | 115.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.86 | 5.86 | 1389.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.79 | 5.19 | 1631.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptococcus sp. 'group A' | EC50 | = | 74.0 | nM | 7.13 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptokinase A | EC50 | = | 115.0 | nM | 6.94 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 1389.0 | nM | 5.86 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
| Unchecked | EC50 | = | 1631.0 | nM | 5.79 | PUBCHEM_BIOASSAY: Luminescence Cell-Based/Microorganism Dose Confirmation HTS to... | - |
| Unchecked | EC50 | = | 7030.0 | nM | 5.15 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS Screen to Identify C... | - |
| Unchecked | EC50 | = | 9774.0 | nM | 5.01 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhi... | - |
| Unchecked | EC50 | = | 15493.0 | nM | 4.81 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Inhibito... | - |
Data from ChEMBL 36 via Core Engine