Compound Detail
CHEMBL1384843
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Basic Information
| ChEMBL ID | CHEMBL1384843 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SVGHCJFDNKNRFW-BJMVGYQFSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
459.7
MW (Da)
5.34
ALogP
4
HBA
1
HBD
72.2
PSA (Ų)
0.38
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.81
IC50 2 meas. best 4.67
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 4.81 | 4.805 | 15547.0 | 2 |
| Envelope glycoprotein gp160 CHEMBL1293311 | IC50 | 4.67 | 4.67 | 21400.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.64 | 4.64 | 22700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 15547.0 | nM | 4.81 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Compounds that Suppress the... | - |
| Unchecked | EC50 | = | 15866.0 | nM | 4.8 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Compounds that Suppress the... | - |
| Envelope glycoprotein gp160 | IC50 | = | 21400.0 | nM | 4.67 | PUBCHEM_BIOASSAY: uHTS fluorescence assay for the identification of Human Immuno... | - |
| Unchecked | IC50 | = | 22700.0 | nM | 4.64 | PUBCHEM_BIOASSAY: A Cell Based Assay for the Identification of Lead Compounds wi... | - |
Data from ChEMBL 36 via Core Engine