Compound Detail
CHEMBL1092114
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Basic Information
| ChEMBL ID | CHEMBL1092114 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LZDAJNLKAUTBLD-OQLLNIDSSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
276.3
MW (Da)
2.73
ALogP
6
HBA
0
HBD
60.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine hydrolase RBBP9 CHEMBL1075121 | IC50 | 5.04 | 5.04 | 9100.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine hydrolase RBBP9 | IC50 | = | 9200.0 | nM | 5.04 | Displacement of fluorophosphate-rhodamine from RBBP9 transfected in human HEK293... | 20207142 |
| Serine hydrolase RBBP9 | IC50 | = | 9100.0 | nM | 5.04 | PUBCHEM_BIOASSAY: Late stage results from the probe development effort to identi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20207142 | 10.1016/j.bmcl.2010.02.011 | Serine hydrolase RBBP9 | 4 |
Data from ChEMBL 36 via Core Engine