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Compound Detail

CHEMBL4866203

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N#Cc1cccc(-n2cc(-c3ccc(/C=C4\C(=O)Nc5ccc(F)cc54)cc3)nn2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4866203
Phase Preclinical
Structure Type MOL
InChI Key NSFWEHSXRCASBU-NHDPSOOVSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

407.4
MW (Da)
4.44
ALogP
5
HBA
1
HBD
83.6
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H14FN5O
MW 407.41
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -1.77

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
33340911 10.1016/j.ejmech.2020.113083 Vascular endothelial growth factor receptor 2 1
33340911 10.1016/j.ejmech.2020.113083 HT-29 1
33340911 10.1016/j.ejmech.2020.113083 MKN-45 1
33340911 10.1016/j.ejmech.2020.113083 HUVEC 1

Data from ChEMBL 36 via Core Engine