Compound Detail
CHEMBL5748905
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Cc1cc(Nc2cc(-c3c[nH]nn3)ccn2)nc(-c2cnc(C3(O)CCC(C(=O)O)CC3)s2)c1
Basic Information
| ChEMBL ID | CHEMBL5748905 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WGLMYJBYLNYKQR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
477.6
MW (Da)
3.90
ALogP
9
HBA
4
HBD
149.8
PSA (Ų)
0.32
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK CHEMBL2599 | IC50 | 10.14 | 10.14 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK | IC50 | = | 0.072 | nM | 10.14 | Homogeneous Time-Resolved Fluorescence (HTRF) Assay: A recombinant GST-hSYK fusi... | - |
Data from ChEMBL 36 via Core Engine