Compound Detail
CHEMBL173258
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Basic Information
| ChEMBL ID | CHEMBL173258 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FIYVXNCTFCIODT-RVDMUPIBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
321.4
MW (Da)
3.41
ALogP
4
HBA
1
HBD
59.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Homo sapiens CHEMBL372 | IC50 | 4.7 | 4.7 | 20000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Homo sapiens | IC50 | = | 20000.0 | nM | 4.7 | In vitro inhibition of ADP-induced aggregation of human platelet rich plasma in ... | 2704033 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2704033 | 10.1021/jm00124a027 | Homo sapiens | 2 |
Data from ChEMBL 36 via Core Engine