Compound Detail
CHEMBL2348517
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Basic Information
| ChEMBL ID | CHEMBL2348517 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BXBQZNDTFPEXHX-KRWDZBQOSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
380.4
MW (Da)
4.41
ALogP
4
HBA
1
HBD
33.7
PSA (Ų)
0.81
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urotensin-2 receptor CHEMBL3764 | IC50 | 6.16 | 6.055 | 691.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urotensin-2 receptor | IC50 | = | 691.0 | nM | 6.16 | Displacement of [125I]-U2 from human recombinant urotensin2 receptor expressed i... | 23453841 |
| Urotensin-2 receptor | IC50 | = | 1130.0 | nM | 5.95 | 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 |
Data from ChEMBL 36 via Core Engine