Compound Detail
CHEMBL6046580
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C=CC(=O)N1C[C@H](n2cc(C#Cc3cc(OC)cc(OC)c3)c3c(N)ncnc32)C[C@@H]1c1nnco1
Basic Information
| ChEMBL ID | CHEMBL6046580 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WISXJFMZEPSSAV-YLJYHZDGSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
485.5
MW (Da)
2.51
ALogP
10
HBA
1
HBD
134.4
PSA (Ų)
0.33
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.92 | 8.92 | 1.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 2 | IC50 | = | 1.2 | nM | 8.92 | FGFR2 Kinase Activity: When setting conditions for the measurement of the inhibi... | - |
Data from ChEMBL 36 via Core Engine