Compound Detail
CHEMBL4441711
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Basic Information
| ChEMBL ID | CHEMBL4441711 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PTYCXMZTZKJFLY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
474.4
MW (Da)
3.93
ALogP
8
HBA
0
HBD
82.7
PSA (Ų)
0.31
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Connector enhancer of kinase suppressor of ras 1 CHEMBL4296242 | Kd | 6.52 | 6.52 | 300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Connector enhancer of kinase suppressor of ras 1 | Kd | = | 300.0 | nM | 6.52 | Binding affinity to CNKSR1 PH-domain (unknown origin) by SPR spectroscopy | - |
Data from ChEMBL 36 via Core Engine