Compound Detail
CHEMBL2323211
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Basic Information
| ChEMBL ID | CHEMBL2323211 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NDIDZGLVGFJXNQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
517.7
MW (Da)
7.17
ALogP
5
HBA
0
HBD
55.8
PSA (Ų)
0.16
QED
2
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HL-60 CHEMBL383 | IC50 | 4.48 | 4.48 | 33000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | IC50 | = | 33000.0 | nM | 4.48 | Antiproliferative activity against human HL60 cells after 48 hrs by MTT assay | 23432053 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23432053 | 10.1021/jm301585z | HL-60 | 2 |
| 23432053 | 10.1021/jm301585z | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine