Compound Detail
CHEMBL5075227
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Basic Information
| ChEMBL ID | CHEMBL5075227 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OWVIJBCOBLSEPW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
451.5
MW (Da)
2.69
ALogP
10
HBA
2
HBD
100.8
PSA (Ų)
0.56
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| JIMT-1 CHEMBL4296443 | IC50 | 6.1 | 6.1 | 800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| JIMT-1 | IC50 | = | 800.0 | nM | 6.1 | Antiproliferative activity against human JIMT-1 cells after 72 hrs by SRB assay | - |
Data from ChEMBL 36 via Core Engine