Compound Detail
CHEMBL32810
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Basic Information
| ChEMBL ID | CHEMBL32810 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CYSRKZFPSNZSCS-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
178.1
MW (Da)
1.20
ALogP
4
HBA
2
HBD
70.7
PSA (Ų)
0.59
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 4.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.41 | 4.41 | 38850.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 38850.0 | nM | 4.41 | Inhibition of alpha-glucosidase using para-nitrophenyl substrate | 21053896 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21053896 | 10.1021/jm100757r | Unchecked | 13 |
| 9003523 | 10.1021/jm960450v | Human immunodeficiency virus type 1 integrase | 2 |
| 15006380 | 10.1016/j.bmcl.2004.01.027 | Human immunodeficiency virus type 1 integrase | 1 |
Data from ChEMBL 36 via Core Engine