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Compound Detail

CHEMBL188903

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CN(C)c1ccc(C(=O)Nc2cncc(-c3cncc(Nc4cccc(Cl)c4)n3)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL188903
Phase Preclinical
Structure Type MOL
InChI Key MKQUABVRXBYMTD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

444.9
MW (Da)
5.25
ALogP
6
HBA
2
HBD
83.0
PSA (Ų)
0.42
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H21ClN6O
MW 444.93
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.78

Literature References

PubMed DOI Target Context # Activities
16033269 10.1021/jm058205b Unchecked 1
16033269 10.1021/jm058205b Vascular endothelial growth factor receptor 2 1

Data from ChEMBL 36 via Core Engine