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Compound Detail

CHEMBL1669305

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O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1-c1cn(-c2cc(F)cc(F)c2)nn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1669305
Phase Preclinical
Structure Type MOL
InChI Key NHHWSISBINUQLS-RRFJBIMHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
16
Publications
0
Known Names

Molecular Properties

407.3
MW (Da)
-0.30
ALogP
9
HBA
3
HBD
135.3
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15F2N5O5
MW 407.33
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.42

Literature References

PubMed DOI Target Context # Activities
21232828 10.1016/j.ejmech.2010.12.017 HEL 2
21232828 10.1016/j.ejmech.2010.12.017 Vesicular stomatitis virus 2
21232828 10.1016/j.ejmech.2010.12.017 Influenza A virus 2
21232828 10.1016/j.ejmech.2010.12.017 Human alphaherpesvirus 1 2
21232828 10.1016/j.ejmech.2010.12.017 Human alphaherpesvirus 3 2
21232828 10.1016/j.ejmech.2010.12.017 Human betaherpesvirus 5 2
21232828 10.1016/j.ejmech.2010.12.017 Influenza B virus 1
21232828 10.1016/j.ejmech.2010.12.017 Human respirovirus 3 1
21232828 10.1016/j.ejmech.2010.12.017 Mammalian orthoreovirus 1 1
21232828 10.1016/j.ejmech.2010.12.017 Sindbis virus 1
21232828 10.1016/j.ejmech.2010.12.017 Punta Toro virus 1
21232828 10.1016/j.ejmech.2010.12.017 Coxsackievirus B4 1
21232828 10.1016/j.ejmech.2010.12.017 Human immunodeficiency virus 1 1
21232828 10.1016/j.ejmech.2010.12.017 Human immunodeficiency virus 2 1
21232828 10.1016/j.ejmech.2010.12.017 Human alphaherpesvirus 2 1
21232828 10.1016/j.ejmech.2010.12.017 Vaccinia virus 1

Data from ChEMBL 36 via Core Engine