Compound Detail
CHEMBL158314
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Basic Information
| ChEMBL ID | CHEMBL158314 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KMRBELHGNXVDRO-NCGLJJJJSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
308.5
MW (Da)
5.76
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.65
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| M-phase inducer phosphatase 1 CHEMBL3775 | IC50 | 4.5 | 4.5 | 32000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| M-phase inducer phosphatase 1 | IC50 | = | 32000.0 | nM | 4.5 | Concentration required for the inhibitory activity against human Cell division c... | 10762037 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10762037 | 10.1016/s0960-894x(00)00065-2 | M-phase inducer phosphatase 1 | 1 |
| 10762037 | 10.1016/s0960-894x(00)00065-2 | SBC-5 | 1 |
Data from ChEMBL 36 via Core Engine