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Compound Detail

CHEMBL1824881

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CC(Oc1cc(C#N)cnc1N)c1c(Cl)ccc(F)c1Cl

Basic Information

ChEMBL ID CHEMBL1824881
Phase Preclinical
Structure Type MOL
InChI Key VIGFRDNZWPHYHT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

326.2
MW (Da)
4.12
ALogP
4
HBA
1
HBD
71.9
PSA (Ų)
0.86
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 C14H10Cl2FN3O
MW 326.16
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.36

Activity Summary

Ki 1 meas. best 5.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
Ki 5.12 5.12 7580.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21812414 10.1021/jm2007613 Hepatocyte growth factor receptor 2

Data from ChEMBL 36 via Core Engine