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Compound Detail

CHEMBL3798619

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c1ccc(COc2ccc(-c3cnc4nnc(Cc5c[nH]c6ccccc56)n4n3)cc2)cc1

Basic Information

ChEMBL ID CHEMBL3798619
Phase Preclinical
Structure Type MOL
InChI Key ODOOSJSQYKPPMA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
4.84
ALogP
6
HBA
1
HBD
81.0
PSA (Ų)
0.41
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H20N6O
MW 432.49
Aromatic Rings 6
Heavy Atoms 33
NP-Likeness -1.13

Activity Summary

IC50 1 meas. best 6.38

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 6.38 6.38 413.2 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
27061987 10.1016/j.ejmech.2016.03.076 TPR/MET fusion protein 2
27061987 10.1016/j.ejmech.2016.03.076 Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine