Compound Detail
CHEMBL3343660
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Basic Information
| ChEMBL ID | CHEMBL3343660 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UXYJCYXWJGAKQY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
323.4
MW (Da)
2.80
ALogP
5
HBA
0
HBD
40.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HGC-27 CHEMBL1075463 | IC50 | 4.26 | 4.26 | 55060.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HGC-27 | IC50 | = | 55060.0 | nM | 4.26 | Antiproliferative activity against human HGC-27 cells assessed as reduction in c... | 35286954 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25277281 | 10.1016/j.bmc.2014.09.004 | Unchecked | 2 |
| 25277281 | 10.1016/j.bmc.2014.09.004 | Neuraminidase | 2 |
| 26321079 | 10.1021/acs.jmedchem.5b00964 | Mus musculus | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | MGC-803 | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | HGC-27 | 1 |
| 35286954 | 10.1016/j.bmc.2022.116705 | GES1 | 1 |
Data from ChEMBL 36 via Core Engine