Compound Detail
CHEMBL337389
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Basic Information
| ChEMBL ID | CHEMBL337389 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RRPRIYZEGMMNAK-MCOSLZNDSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
19
Publications
0
Known Names
Molecular Properties
276.3
MW (Da)
-1.20
ALogP
9
HBA
3
HBD
143.1
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 5.24 | 5.24 | 5800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 5800.0 | nM | 5.24 | Tested in vitro inhibitory activity against murine leukemia L1210 | 8277499 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17402726 | 10.1021/jm070032y | Human gammaherpesvirus 8 | 2 |
| 8277499 | 10.1021/jm00078a006 | KKLS | 1 |
| 17402726 | 10.1021/jm070032y | ADMET | 1 |
| 8277499 | 10.1021/jm00078a006 | A-375 | 1 |
| 8277499 | 10.1021/jm00078a006 | HT-1080 | 1 |
| 8277499 | 10.1021/jm00078a006 | HOS-TE85 | 1 |
| 8277499 | 10.1021/jm00078a006 | OST | 1 |
| 8277499 | 10.1021/jm00078a006 | MCF7 | 1 |
| 8277499 | 10.1021/jm00078a006 | COLO 320 | 1 |
| 8277499 | 10.1021/jm00078a006 | SW48 | 1 |
| 8277499 | 10.1021/jm00078a006 | L1210 | 1 |
| 8277499 | 10.1021/jm00078a006 | KATO III stomach cancer cell line | 1 |
| 8277499 | 10.1021/jm00078a006 | MKN-45 | 1 |
| 8277499 | 10.1021/jm00078a006 | ST-KM-1 | 1 |
| 8277499 | 10.1021/jm00078a006 | QG-95 | 1 |
| 8277499 | 10.1021/jm00078a006 | PC-13 | 1 |
| 8277499 | 10.1021/jm00078a006 | PC-9 | 1 |
| 8277499 | 10.1021/jm00078a006 | PC-8 | 1 |
| 8277499 | 10.1021/jm00078a006 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine