Compound Detail
CHEMBL422780
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Basic Information
| ChEMBL ID | CHEMBL422780 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKFORZPFABJQKU-QGZVFWFLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
313.5
MW (Da)
3.48
ALogP
3
HBA
3
HBD
81.1
PSA (Ų)
0.38
QED
0
Ro5 Violations
16
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HL-60 CHEMBL383 | EC50 | 6.1 | 6.1 | 794.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | EC50 | = | 794.33 | nM | 6.1 | -log of the half-maximal concentration for stimulation of GTPase in HL-60 membra... | 9301677 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9301677 | 10.1021/jm9703092 | HL-60 | 2 |
Data from ChEMBL 36 via Core Engine