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Compound Detail

CHEMBL132089

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Nc1cc2nc(N)c(-c3c(Cl)cccc3Cl)cc2cn1

Basic Information

ChEMBL ID CHEMBL132089
Phase Preclinical
Structure Type MOL
InChI Key RFCMDTOLDNJWEN-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

305.2
MW (Da)
3.77
ALogP
4
HBA
2
HBD
77.8
PSA (Ų)
0.72
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 C14H10Cl2N4
MW 305.17
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.39

Activity Summary

IC50 3 meas. best 6.17

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Proto-oncogene tyrosine-protein kinase Src
CHEMBL267
IC50 6.17 6.17 680.0 1
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 5.55 5.55 2800.0 1
Platelet-derived growth factor receptor beta
CHEMBL2749
IC50 4.46 4.46 35000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11063616 10.1021/jm000161d Fibroblast growth factor receptor 1 1
11063616 10.1021/jm000161d Platelet-derived growth factor receptor beta 1
11063616 10.1021/jm000161d Proto-oncogene tyrosine-protein kinase Src 1

Data from ChEMBL 36 via Core Engine