Compound Detail
CHEMBL397565
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Basic Information
| ChEMBL ID | CHEMBL397565 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GHSJKUNUIHUPDF-BYPYZUCNSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
164.2
MW (Da)
-0.91
ALogP
4
HBA
3
HBD
89.3
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 4.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 4.52 | 4.52 | 30000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 30000.0 | nM | 4.52 | Binding affinity to lysC riboswitch in Bacillus subtilis | 25603286 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C9MD00107G | 4-hydroxy-tetrahydrodipicolinate synthase | 4 |
| 17524640 | 10.1016/j.bmcl.2007.04.101 | Kinesin-like protein KIF11 | 1 |
| 17524640 | 10.1016/j.bmcl.2007.04.101 | HeLa | 1 |
| 17143270 | 10.1038/nchembio842 | Nucleic Acid | 1 |
| 412965 | 10.1021/jm00222a017 | No relevant target | 1 |
| 412965 | 10.1021/jm00222a017 | Unchecked | 1 |
| 412965 | 10.1021/jm00222a017 | P388 | 1 |
| 25603286 | 10.1021/jm500868e | Unchecked | 1 |
| 25603286 | 10.1021/jm500868e | Bacillus subtilis | 1 |
Data from ChEMBL 36 via Core Engine