Compound Detail
CHEMBL1533835
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Basic Information
| ChEMBL ID | CHEMBL1533835 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XXIFMDZHVXHDBW-UHFFFAOYSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
284.2
MW (Da)
2.87
ALogP
4
HBA
1
HBD
67.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 6.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.34 | 6.34 | 457.0 | 1 |
| Luciferin 4-monooxygenase CHEMBL5567 | EC50 | 6.14 | 6.14 | 731.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.14 | 5.14 | 7307.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 4.97 | 4.97 | 10697.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 4.8 | 4.8 | 15734.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 457.0 | nM | 6.34 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhi... | - |
| Luciferin 4-monooxygenase | EC50 | = | 731.0 | nM | 6.14 | PUBCHEM_BIOASSAY: Luminescence Biochemical Dose Response HTS to Identify Inhibit... | - |
| Streptokinase A | EC50 | = | 7307.0 | nM | 5.14 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus sp. 'group A' | EC50 | = | 10697.0 | nM | 4.97 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 15734.0 | nM | 4.8 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
Data from ChEMBL 36 via Core Engine