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Compound Detail

CHEMBL3401362

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Cc1ccc(-c2nc3c(O)nc(N)nc3[nH]2)c(C)c1

Basic Information

ChEMBL ID CHEMBL3401362
Phase Preclinical
Structure Type MOL
InChI Key RCDBNYNKFLYGLH-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

255.3
MW (Da)
1.92
ALogP
5
HBA
3
HBD
100.7
PSA (Ų)
0.62
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H13N5O
MW 255.28
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -0.85

Activity Summary

IC50 2 meas. best 4.9

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 4.9 4.9 12650.0 1
Fibroblast growth factor receptor 2
CHEMBL4142
IC50 4.75 4.75 17710.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
25736993 10.1016/j.bmcl.2015.02.010 Fibroblast growth factor receptor 4 1
25736993 10.1016/j.bmcl.2015.02.010 Fibroblast growth factor receptor 3 1
25736993 10.1016/j.bmcl.2015.02.010 Fibroblast growth factor receptor 2 1
25736993 10.1016/j.bmcl.2015.02.010 Fibroblast growth factor receptor 1 1

Data from ChEMBL 36 via Core Engine