Compound Detail
CHEMBL1203712
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Basic Information
| ChEMBL ID | CHEMBL1203712 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LHJVTBJGDSNMFX-UHFFFAOYSA-N |
| Parent Compound | CHEMBL162245 |
| Active Moiety | CHEMBL162245 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
321.4
MW (Da)
3.46
ALogP
3
HBA
1
HBD
45.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 6.2 | 6.2 | 630.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 630.0 | nM | 6.2 | Inhibition murine leukemia L1210 cell growth in culture | 3560161 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3560161 | 10.1021/jm00387a014 | No relevant target | 2 |
| 3560161 | 10.1021/jm00387a014 | Nucleic Acid | 2 |
| 3560161 | 10.1021/jm00387a014 | L1210 | 1 |
| 3560161 | 10.1021/jm00387a014 | HCT-8 | 1 |
| 3560161 | 10.1021/jm00387a014 | Unchecked | 1 |
| 3560161 | 10.1021/jm00387a014 | P388 | 1 |
| 3560161 | 10.1021/jm00387a014 | Lewis lung carcinoma cell line | 1 |
Data from ChEMBL 36 via Core Engine