Compound Detail
CHEMBL132252
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Basic Information
| ChEMBL ID | CHEMBL132252 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KWPGVLHMBOESPK-VCHYOVAHSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
293.3
MW (Da)
3.32
ALogP
3
HBA
3
HBD
73.7
PSA (Ų)
0.29
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.36
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 4400.0 | nM | 5.36 | Activity against lymphocytic murine leukemia cell line L1210 using MTS/PES micro... | 11784145 |
| L1210 | IC50 | = | 4395.42 | nM | 5.36 | Cytotoxicity against mouse L1210 cells after 65 hrs by MTS/PES microculture tetr... | 21536434 |
| L1210 | IC50 | = | 6500.0 | nM | 5.19 | Antiproliferative activity against mouse L1210 cells after 24 hrs by MTS assay | 23673213 |
| KB | IC50 | = | 8900.0 | nM | 5.05 | Antiproliferative activity against hydroxyurea-resistant human KB cells after 24... | 23673213 |
| KB | IC50 | = | 9300.0 | nM | 5.03 | Antiproliferative activity against wild-type human KB cells after 24 hrs by MTS ... | 23673213 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11784145 | 10.1021/jm010252q | No relevant target | 2 |
| 23673213 | 10.1016/j.bmc.2013.04.037 | KB | 2 |
| 11784145 | 10.1021/jm010252q | L1210 | 1 |
| 14521406 | 10.1021/jm030016a | L1210 | 1 |
| 21536434 | 10.1016/j.bmcl.2011.04.009 | L1210 | 1 |
| 23673213 | 10.1016/j.bmc.2013.04.037 | L1210 | 1 |
Data from ChEMBL 36 via Core Engine