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Compound Detail

CHEMBL3260952

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Cc1ccc(N2CCCC(C(=O)Nc3ccc(Oc4ccnc(N)c4Cl)c(F)c3)S2(=O)=O)cc1

Basic Information

ChEMBL ID CHEMBL3260952
Phase Preclinical
Structure Type MOL
InChI Key RKLPFFXNQXCINY-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

505.0
MW (Da)
4.49
ALogP
6
HBA
2
HBD
114.6
PSA (Ų)
0.53
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H22ClFN4O4S
MW 504.97
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.39

Activity Summary

IC50 1 meas. best 6.78

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 6.78 6.78 165.5 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
24792774 10.1016/j.ejmech.2014.04.056 Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine