Compound Detail
CHEMBL5971643
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Basic Information
| ChEMBL ID | CHEMBL5971643 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UBLNFNBECGUOCZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
501.4
MW (Da)
3.23
ALogP
7
HBA
4
HBD
125.2
PSA (Ų)
0.19
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Indoleamine 2,3-dioxygenase 1 CHEMBL4685 | IC50 | 7.43 | 7.43 | 37.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Indoleamine 2,3-dioxygenase 1 | IC50 | = | 37.0 | nM | 7.43 | Enzyme Assay: HIS-tagged IDO1 protein was recombinantly expressed in Escherichia... | - |
Data from ChEMBL 36 via Core Engine