Compound Detail
CHEMBL2348501
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Basic Information
| ChEMBL ID | CHEMBL2348501 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KQCZCINJGIRLCD-CYBMUJFWSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
505.8
MW (Da)
4.00
ALogP
6
HBA
1
HBD
77.1
PSA (Ų)
0.61
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urotensin-2 receptor CHEMBL3764 | IC50 | 7.64 | 7.505 | 23.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urotensin-2 receptor | IC50 | = | 23.0 | nM | 7.64 | Displacement of [125I]-U2 from human recombinant urotensin2 receptor expressed i... | 23453841 |
| Urotensin-2 receptor | IC50 | = | 43.0 | nM | 7.37 | Antagonist activity at recombinant human urotensin2 receptor expressed in CHO ce... | 23453841 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23453841 | 10.1016/j.bmcl.2013.01.105 | Urotensin-2 receptor | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 23453841 | 10.1016/j.bmcl.2013.01.105 | Liver microsomes | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine