Compound Detail
CHEMBL455499
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Basic Information
| ChEMBL ID | CHEMBL455499 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZUHTZMWRNXWLN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
149.2
MW (Da)
1.84
ALogP
3
HBA
1
HBD
46.3
PSA (Ų)
0.62
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D-amino-acid oxidase CHEMBL6172 | IC50 | 6.57 | 6.57 | 269.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D-amino-acid oxidase | IC50 | = | 269.0 | nM | 6.57 | Inhibition of pig D-amino acid oxidase | 18507366 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18507366 | 10.1021/jm800200u | D-amino-acid oxidase | 1 |
Data from ChEMBL 36 via Core Engine