Compound Detail
CHEMBL3184300
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Basic Information
| ChEMBL ID | CHEMBL3184300 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | USYMCUGEGUFUBI-UHFFFAOYSA-N |
1
Targets
8
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
222.0
MW (Da)
1.15
ALogP
5
HBA
1
HBD
78.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 6.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.8 | 6.22 | 156.5 | 8 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 156.5 | nM | 6.8 | PubChem BioAssay. alkaline phosphatase stimulation in WNT3A conditioned C2C12 ce... | - |
| Unchecked | IC50 | = | 308.5 | nM | 6.51 | PubChem BioAssay. nuclear beta catenin stimulation in WNT3A conditioned C2C12 ce... | - |
| Unchecked | IC50 | = | 334.1 | nM | 6.48 | PubChem BioAssay. Increased HeLa cells with 2N DNA content-IC50. (Class of ass... | - |
| Unchecked | IC50 | = | 407.5 | nM | 6.39 | PubChem BioAssay. Decreased HeLa cell count-IC50. (Class of assay: confirmator... | - |
| Unchecked | IC50 | = | 511.5 | nM | 6.29 | PubChem BioAssay. Increased HeLa cells with 4N DNA content-IC50. (Class of ass... | - |
| Unchecked | IC50 | = | 865.2 | nM | 6.06 | PubChem BioAssay. VEGF stimulated ADSC/ECFC co-culture CD31-stained tube area de... | - |
| Unchecked | IC50 | = | 868.1 | nM | 6.06 | PubChem BioAssay. Increased chromatin condensation in HeLa cells-IC50. (Class ... | - |
| Unchecked | IC50 | = | 6796.16 | nM | 5.17 | PubChem BioAssay. VEGF stimulated ADSC/ECFC co-culture nuclear area decrease (vi... | - |
Data from ChEMBL 36 via Core Engine