Compound Detail
CHEMBL3694250
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Basic Information
| ChEMBL ID | CHEMBL3694250 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SGYXYQQGWNUEIG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
398.6
MW (Da)
5.38
ALogP
2
HBA
1
HBD
24.9
PSA (Ų)
0.59
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dihydroorotate dehydrogenase CHEMBL3486 | IC50 | 6.24 | 6.24 | 580.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dihydroorotate dehydrogenase | IC50 | = | 580.0 | nM | 6.24 | Enzymatic Assays: Type 2 DHODH activity was monitored with either the direct ass... | - |
Data from ChEMBL 36 via Core Engine