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Compound Detail

CHEMBL337100

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Cn1c(=O)c(-c2ccc(-c3ccccc3)cc2)cc2cnc(Nc3ccccc3)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL337100
Phase Preclinical
Structure Type MOL
InChI Key JRPILPQRYRFPBA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

404.5
MW (Da)
5.41
ALogP
5
HBA
1
HBD
59.8
PSA (Ų)
0.44
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H20N4O
MW 404.47
Aromatic Rings 5
Heavy Atoms 31
NP-Likeness -0.77

Literature References

PubMed DOI Target Context # Activities
9784112 10.1021/jm980398y Platelet-derived growth factor receptor 1
9784112 10.1021/jm980398y Fibroblast growth factor receptor 1
9784112 10.1021/jm980398y Proto-oncogene tyrosine-protein kinase Src 1

Data from ChEMBL 36 via Core Engine