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Compound Detail

CHEMBL205113

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O=C(Nc1ccc(Cl)cc1)c1scnc1CCc1noc2ccccc12

Basic Information

ChEMBL ID CHEMBL205113
Phase Preclinical
Structure Type MOL
InChI Key TWYDWDXNSAXLDL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

383.9
MW (Da)
4.98
ALogP
5
HBA
1
HBD
68.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14ClN3O2S
MW 383.86
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.71

Literature References

PubMed DOI Target Context # Activities
16275072 10.1016/j.bmcl.2005.10.058 Vascular endothelial growth factor receptor 2 2
16275072 10.1016/j.bmcl.2005.10.058 Vascular endothelial growth factor receptor 1 1

Data from ChEMBL 36 via Core Engine