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Compound Detail

CHEMBL4076032

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Cc1ccc(F)c(NC(=O)Nc2ccc(C3CC(O)=Nc4[nH]nc(C)c43)cc2)c1

Basic Information

ChEMBL ID CHEMBL4076032
Phase Preclinical
Structure Type MOL
InChI Key KVBOCAZZUXCBCJ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

393.4
MW (Da)
4.93
ALogP
3
HBA
4
HBD
102.4
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H20FN5O2
MW 393.42
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.70

Activity Summary

IC50 1 meas. best 4.47

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 4.47 4.47 33849.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
28541695 10.1021/acs.jmedchem.7b00468 Platelet-derived growth factor receptor alpha 3
28541695 10.1021/acs.jmedchem.7b00468 Mast/stem cell growth factor receptor Kit 2
28541695 10.1021/acs.jmedchem.7b00468 Fibroblast growth factor receptor 1 1
28541695 10.1021/acs.jmedchem.7b00468 Vascular endothelial growth factor receptor 2 1

Data from ChEMBL 36 via Core Engine