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Compound Detail

CHEMBL3676317

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Cc1nc2cc(-n3ncc(C(=O)c4cc5cc(F)c(Br)cc5[nH]4)c3N)ccc2[nH]1

Basic Information

ChEMBL ID CHEMBL3676317
Phase Preclinical
Structure Type MOL
InChI Key XRLFKHYILNWINJ-UHFFFAOYSA-N
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

453.3
MW (Da)
4.25
ALogP
5
HBA
3
HBD
105.4
PSA (Ų)
0.36
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 C20H14BrFN6O
MW 453.27
Aromatic Rings 5
Heavy Atoms 29
NP-Likeness -1.81

Activity Summary

IC50 6 meas. best 8.07

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 2
CHEMBL4142
IC50 8.07 8.07 8.5 2
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 7.51 7.51 31.0 2
Fibroblast growth factor receptor 3
CHEMBL2742
IC50 6.3 6.3 500.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine