Compound Detail
CHEMBL5857112
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C=CC(=O)N1CC[C@H](N2C=C(C#Cc3cc(OC)cc(OC)c3)C3C(N)=NC=NC32)C1
Basic Information
| ChEMBL ID | CHEMBL5857112 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GTFOOGQULWFGTI-HLFJOQDNSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
419.5
MW (Da)
1.38
ALogP
7
HBA
1
HBD
92.8
PSA (Ų)
0.59
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 9.4 | 9.4 | 0.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 2 | IC50 | = | 0.4 | nM | 9.4 | Measurement of Inhibitory Effect on FGFR2 Kinase Activity: When setting conditio... | - |
Data from ChEMBL 36 via Core Engine