Compound Detail
CHEMBL1965860
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Basic Information
| ChEMBL ID | CHEMBL1965860 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WRQPNTFOWSEHKM-CIAFOILYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
366.3
MW (Da)
4.42
ALogP
2
HBA
2
HBD
36.4
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.33
IC50 1 meas. best 4.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.33 | 5.33 | 4656.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.18 | 5.18 | 6559.0 | 1 |
| C-C chemokine receptor type 6 CHEMBL4423 | IC50 | 4.82 | 4.82 | 15100.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 4.67 | 4.67 | 21245.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptococcus sp. 'group A' | EC50 | = | 4656.0 | nM | 5.33 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptokinase A | EC50 | = | 6559.0 | nM | 5.18 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| C-C chemokine receptor type 6 | IC50 | = | 15100.0 | nM | 4.82 | PUBCHEM_BIOASSAY: Dose Response confirmation of small molecule antagonists of th... | - |
| Streptococcus | EC50 | = | 21245.0 | nM | 4.67 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
Data from ChEMBL 36 via Core Engine