Compound Detail
CHEMBL3217841
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Basic Information
| ChEMBL ID | CHEMBL3217841 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KPUQSLPNSSYVBH-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
1
PK Parameters
1
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
2.43
ALogP
5
HBA
1
HBD
66.8
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.63 | 5.2233 | 2350.0 | 3 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| Ka | 1.85 | 10'-6/M | Not specified |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 2350.0 | nM | 5.63 | Binding affinity to poly(A) tail mRNA (unknown origin) assessed as apparent bind... | - |
| Unchecked | Ki | = | 3080.0 | nM | 5.51 | Binding affinity to poly(A) tail mRNA (unknown origin) assessed as apparent bind... | - |
| Unchecked | Ki | = | 29700.0 | nM | 4.53 | Binding affinity to poly(A) tail mRNA (unknown origin) assessed as cooperative b... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C0MD00209G | Unchecked | 8 |
Data from ChEMBL 36 via Core Engine