Compound Detail
CHEMBL352671
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Basic Information
| ChEMBL ID | CHEMBL352671 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MYLGGNIYTZPDGN-KSEXSDGBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
16
Publications
0
Known Names
Molecular Properties
455.5
MW (Da)
6.05
ALogP
3
HBA
3
HBD
49.1
PSA (Ų)
0.22
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MT4 CHEMBL388 | EC50 | 5.62 | 5.62 | 2400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MT4 | EC50 | = | 2400.0 | nM | 5.62 | Tested for cytotoxic concentration required to reduce the viability of MT-4 cell... | 11858989 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11858989 | 10.1016/s0960-894x(01)00838-1 | E6SM | 6 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Vero | 6 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | HEL | 4 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | CCRF-CEM | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | MOLT-4 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | HuT78 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | RPMI-8226 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | K562 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | HL-60 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | MT4 | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | HeLa | 3 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Staphylococcus aureus | 1 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Staphylococcus epidermidis | 1 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Staphylococcus hominis | 1 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Klebsiella pneumoniae | 1 |
| 11858989 | 10.1016/s0960-894x(01)00838-1 | Escherichia coli | 1 |
Data from ChEMBL 36 via Core Engine