Compound Detail
CHEMBL35055
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Basic Information
| ChEMBL ID | CHEMBL35055 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LGDNJXAZBBKQQZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
324.4
MW (Da)
1.28
ALogP
5
HBA
4
HBD
100.3
PSA (Ų)
0.40
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 7.11 | 7.11 | 77.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 77.0 | nM | 7.11 | Evaluated for concentration which when added to cultures of L1210 leukemia cells... | 3572974 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3572974 | 10.1021/jm00388a019 | Calf thymus DNA | 9 |
| 6492078 | 10.1021/jm00377a017 | No relevant target | 2 |
| 6492078 | 10.1021/jm00377a017 | ADMET | 2 |
| 3572974 | 10.1021/jm00388a019 | P388 | 2 |
| 6492078 | 10.1021/jm00377a017 | L1210 | 1 |
| 6492078 | 10.1021/jm00377a017 | HCT-8 | 1 |
| 6492078 | 10.1021/jm00377a017 | Mus musculus | 1 |
| 3572974 | 10.1021/jm00388a019 | L1210 | 1 |
| 3572974 | 10.1021/jm00388a019 | Nucleic Acid | 1 |
Data from ChEMBL 36 via Core Engine