Compound Detail
CHEMBL5847691
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Cc1nc2cc(-n3ncc(C(=O)c4cc5cc(CN6CCN(S(C)(=O)=O)CC6)ccc5[nH]4)c3N)ccc2[nH]1
Basic Information
| ChEMBL ID | CHEMBL5847691 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TUJGAAZZROOKNS-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
532.6
MW (Da)
2.43
ALogP
8
HBA
3
HBD
146.0
PSA (Ų)
0.28
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.1 | 8.1 | 7.9 | 1 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 7.44 | 7.44 | 36.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 | IC50 | = | 7.9 | nM | 8.1 | Inhibition Kinase Activity Assay: The FGFR1 inhibitory activities of compounds w... | - |
| Fibroblast growth factor receptor 2 | IC50 | = | 11.0 | nM | 7.96 | Inhibition Kinase Activity Assay: The FGFR2 inhibitory activities of compounds l... | - |
| Fibroblast growth factor receptor 3 | IC50 | = | 36.0 | nM | 7.44 | Inhibition Kinase Activity Assay: The FGFR3 inhibitory activities of compounds l... | - |
Data from ChEMBL 36 via Core Engine