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Compound Detail

CHEMBL573765

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COc1cc2ncnc(Nc3ccc(NC(=O)N4CCN(c5ccccc5)C4=O)cc3F)c2cc1OC

Basic Information

ChEMBL ID CHEMBL573765
Phase Preclinical
Structure Type MOL
InChI Key BEYUGPLUWSNIHT-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

502.5
MW (Da)
5.00
ALogP
7
HBA
2
HBD
108.9
PSA (Ų)
0.38
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23FN6O4
MW 502.51
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -1.62

Activity Summary

IC50 2 meas. best 6.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 6.22 5.85 600.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
19854051 10.1016/j.bmcl.2009.10.040 Hepatocyte growth factor receptor 2
19854051 10.1016/j.bmcl.2009.10.040 Unchecked 1

Data from ChEMBL 36 via Core Engine