Compound Detail
CHEMBL1785025
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Basic Information
| ChEMBL ID | CHEMBL1785025 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FMTNOFXBEYMHRW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
359.5
MW (Da)
5.02
ALogP
6
HBA
1
HBD
69.6
PSA (Ų)
0.48
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 3000.0 | nM | 5.52 | Inhibition of Cryptosporidium parvum recombinant N-terminal hexahistidine tagged... | 21116453 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21116453 | 10.1021/ml100096t | Unchecked | 1 |
| 21116453 | 10.1021/ml100096t | Calmodulin-domain protein kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine