Compound Detail
CHEMBL1240949
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1240949 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZFUSOVIZZGBORZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
150.2
MW (Da)
1.90
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.62
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HT-29 CHEMBL384 | IC50 | 4.89 | 4.89 | 13000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HT-29 | IC50 | = | 13000.0 | nM | 4.89 | Cytotoxicity against human HT-29 cells after 72 hrs by XTT assay | 20619940 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20619940 | 10.1016/j.ejmech.2010.06.025 | HeLa | 1 |
| 20619940 | 10.1016/j.ejmech.2010.06.025 | A549 | 1 |
| 20619940 | 10.1016/j.ejmech.2010.06.025 | HT-29 | 1 |
| 20619940 | 10.1016/j.ejmech.2010.06.025 | HL-60 | 1 |
Data from ChEMBL 36 via Core Engine