Compound Detail
CHEMBL1458477
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Basic Information
| ChEMBL ID | CHEMBL1458477 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XAVNBAPLEZJUSM-UHFFFAOYSA-N |
| Parent Compound | CHEMBL268356 |
| Active Moiety | CHEMBL268356 |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
289.3
MW (Da)
1.05
ALogP
7
HBA
2
HBD
106.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Streptokinase A CHEMBL1293228 | EC50 | 6.96 | 6.96 | 109.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 6.9 | 6.9 | 127.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 6.2 | 6.2 | 630.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Streptokinase A | EC50 | = | 109.0 | nM | 6.96 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus sp. 'group A' | EC50 | = | 127.0 | nM | 6.9 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 630.0 | nM | 6.2 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
Data from ChEMBL 36 via Core Engine