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Compound Detail

CHEMBL39563

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Brc1cccc(Nc2nccc3ccccc23)c1

Basic Information

ChEMBL ID CHEMBL39563
Phase Preclinical
Structure Type MOL
InChI Key XLUUAOKSTRHPIZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

299.2
MW (Da)
4.74
ALogP
2
HBA
1
HBD
24.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11BrN2
MW 299.17
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness -1.18

Literature References

PubMed DOI Target Context # Activities
9154973 10.1021/jm960789h Epidermal growth factor receptor 1
7658435 10.1021/jm00018a008 Epidermal growth factor receptor 1

Data from ChEMBL 36 via Core Engine