Compound Detail
CHEMBL572203
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Basic Information
| ChEMBL ID | CHEMBL572203 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ATGUVEKSASEFFO-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
184.2
MW (Da)
3.01
ALogP
2
HBA
2
HBD
38.0
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.58
IC50 2 meas. best 4.04
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HT-22 | EC50 | = | 26.0 | nM | 7.58 | Neuroprotective activity in mouse HT22 cells assessed as protection against glut... | 24602904 |
| Unchecked | EC50 | = | 11600.0 | nM | 4.94 | PUBCHEM_BIOASSAY: A cytotoxicity screen of small molecule inhibitors of the PhoP... | - |
| Unchecked | IC50 | = | 92110.0 | nM | 4.04 | PUBCHEM_BIOASSAY: A screen for inhibitors of the PhoP region in Salmonella Typhi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20055453 | 10.1021/jm9014718 | Indoleamine 2,3-dioxygenase 1 | 1 |
| 24602904 | 10.1016/j.bmcl.2014.02.006 | HT-22 | 1 |
Data from ChEMBL 36 via Core Engine