Compound Detail
CHEMBL59373
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Basic Information
| ChEMBL ID | CHEMBL59373 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VKNJBICPCNOEJD-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
299.4
MW (Da)
2.39
ALogP
3
HBA
2
HBD
83.5
PSA (Ų)
0.65
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 6.54 | 6.045 | 290.0 | 2 |
| Oryctolagus cuniculus CHEMBL374 | IC50 | 6.16 | 6.16 | 700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 290.0 | nM | 6.54 | In vitro inhibitory concentration measured against collagen (4 uML) induced aggr... | 1829486 |
| Oryctolagus cuniculus | IC50 | = | 700.0 | nM | 6.16 | In vitro inhibitory concentration measured against U-46,619 (1 uM) induced aggre... | 1829486 |
| Rattus norvegicus | IC50 | = | 2800.0 | nM | 5.55 | In vitro inhibitory concentration measured against U-46,619 (30 nM) induced cont... | 1829486 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1829486 | 10.1021/jm00110a020 | Rattus norvegicus | 2 |
| 1829486 | 10.1021/jm00110a020 | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine