Compound Detail
CHEMBL257207
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Basic Information
| ChEMBL ID | CHEMBL257207 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ARPFWVKYXJZULB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
4
Publications
0
Known Names
Molecular Properties
472.0
MW (Da)
3.74
ALogP
5
HBA
3
HBD
90.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Coagulation factor X CHEMBL244 | IC50 | 7.39 | 7.39 | 41.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 81.0 | mL.min-1.kg-1 | Homo sapiens |
| T1/2 | 0.1283 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Coagulation factor X | IC50 | = | 41.0 | nM | 7.39 | Inhibition of human factor 10a | 18039572 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18039572 | 10.1016/j.bmcl.2007.11.037 | Liver microsomes | 2 |
| 18039572 | 10.1016/j.bmcl.2007.11.037 | Coagulation factor X | 1 |
| 18039572 | 10.1016/j.bmcl.2007.11.037 | No relevant target | 1 |
| 18039572 | 10.1016/j.bmcl.2007.11.037 | Plasma | 1 |
Data from ChEMBL 36 via Core Engine