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Compound Detail

CHEMBL4100408

TP-024n
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Cc1nc(Cc2cccc(C(F)(F)F)c2)sc1-c1ccc(C(N)=O)nc1

Basic Information

ChEMBL ID CHEMBL4100408
Name TP-024n
Phase Preclinical
Structure Type MOL
InChI Key LEEQPBKUBIMCLS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
4.22
ALogP
4
HBA
1
HBD
68.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14F3N3OS
MW 377.39
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.48

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4689842 HEK-293T 345
- 10.6019/CHEMBL4689842 U2OS 344
- 10.6019/CHEMBL4689842 Fibroblast 344
- 10.6019/CHEMBL4507305 Tyrosine-protein kinase ABL1 15
- 10.6019/CHEMBL5724558 Colon cancer organoid 12
- 10.6019/CHEMBL4507305 Epidermal growth factor receptor 12
- 10.6019/CHEMBL5674860 Colon cancer organoid 12
- 10.6019/CHEMBL4507305 Receptor-type tyrosine-protein kinase FLT3 11
- 10.6019/CHEMBL4507305 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform 10
- 10.6019/CHEMBL4507305 Mast/stem cell growth factor receptor Kit 9
- 10.6019/CHEMBL4507305 Unchecked 8
- 10.6019/CHEMBL5608141 Colon cancer organoid 6
- 10.1158/2159-8290.CD-23-0050 Colon cancer organoid 5
- 10.6019/CHEMBL4507305 Proto-oncogene tyrosine-protein kinase receptor Ret 4
- 10.6019/CHEMBL4507305 Hepatocyte growth factor receptor 3
- 10.6019/CHEMBL4507305 ALK tyrosine kinase receptor 3
- 10.6019/CHEMBL4507305 Ribosomal protein S6 kinase alpha-5 2
- 10.6019/CHEMBL4507305 Tyrosine-protein kinase JAK1 2
- 10.6019/CHEMBL4507305 Ribosomal protein S6 kinase alpha-4 2
- 10.6019/CHEMBL4507305 Macrophage colony-stimulating factor 1 receptor 2

Data from ChEMBL 36 via Core Engine