Compound Detail
CHEMBL1349631
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Basic Information
| ChEMBL ID | CHEMBL1349631 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VZLUNLPYLKJNQR-UHFFFAOYSA-N |
5
Targets
7
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
263.3
MW (Da)
4.66
ALogP
4
HBA
1
HBD
57.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 7 meas. best 7.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptokinase A CHEMBL1293228 | EC50 | 7.01 | 7.01 | 98.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 6.78 | 6.78 | 165.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 6.16 | 5.22 | 686.0 | 3 |
| Streptococcus CHEMBL612313 | EC50 | 5.81 | 5.81 | 1557.0 | 1 |
| Voltage-gated inwardly rectifying potassium channel KCNH2 CHEMBL240 | EC50 | 5.7 | 5.7 | 2020.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptokinase A | EC50 | = | 98.0 | nM | 7.01 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus sp. 'group A' | EC50 | = | 165.0 | nM | 6.78 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Unchecked | EC50 | = | 686.0 | nM | 6.16 | PUBCHEM_BIOASSAY: Luminescence Cell-Based/Microorganism Dose Confirmation HTS to... | - |
| Streptococcus | EC50 | = | 1557.0 | nM | 5.81 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
| Voltage-gated inwardly rectifying potassium channel KCNH2 | EC50 | = | 2020.0 | nM | 5.7 | PUBCHEM_BIOASSAY: Confirmation Dose Response screen for compounds that protect h... | - |
| Unchecked | EC50 | = | 9691.0 | nM | 5.01 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Confirmation at Dose to Identify Trans... | - |
| Unchecked | EC50 | = | 32676.0 | nM | 4.49 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS Screen to Identify C... | - |
Data from ChEMBL 36 via Core Engine