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Compound Detail

CHEMBL190371

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Clc1cccc(Nc2cncc(-c3cncc(NCCOc4ccccc4)c3)n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL190371
Phase Preclinical
Structure Type MOL
InChI Key GNKGBKAHMOQPNP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

417.9
MW (Da)
5.43
ALogP
6
HBA
2
HBD
72.0
PSA (Ų)
0.37
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H20ClN5O
MW 417.90
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.61

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