Compound Detail
CHEMBL162738
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Basic Information
| ChEMBL ID | CHEMBL162738 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KJYYVKYSBVQXBM-NVNXTCNLSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
19
Publications
0
Known Names
Molecular Properties
251.4
MW (Da)
2.82
ALogP
2
HBA
2
HBD
50.7
PSA (Ų)
0.34
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.12
IC50 1 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MT4 CHEMBL388 | EC50 | 5.12 | 5.12 | 7500.0 | 1 |
| Trypanosoma brucei brucei CHEMBL612851 | IC50 | 5.08 | 5.08 | 8380.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MT4 | EC50 | = | 7500.0 | nM | 5.12 | Tested for cytotoxic concentration required to reduce the viability of MT-4 cell... | 11858989 |
| Trypanosoma brucei brucei | IC50 | = | 8380.0 | nM | 5.08 | Trypanocidal activity against Trypanosoma brucei brucei 427 bloodstream form ass... | - |
Literature References
Data from ChEMBL 36 via Core Engine