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Compound Detail

CHEMBL1762229

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C=C1[C@H](O)[C@H](O)CO[C@@H]1n1ccc(O)nc1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1762229
Phase Preclinical
Structure Type MOL
InChI Key CDVHCMIDHIPPEG-YEPSODPASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
14
Publications
0
Known Names

Molecular Properties

240.2
MW (Da)
-1.24
ALogP
7
HBA
3
HBD
104.8
PSA (Ų)
0.53
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H12N2O5
MW 240.22
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.98

Literature References

PubMed DOI Target Context # Activities
21330014 10.1016/j.ejmech.2011.01.005 Vesicular stomatitis virus 2
21330014 10.1016/j.ejmech.2011.01.005 Coxsackievirus B4 2
21330014 10.1016/j.ejmech.2011.01.005 L1210 1
21330014 10.1016/j.ejmech.2011.01.005 FM3A 1
21330014 10.1016/j.ejmech.2011.01.005 CCRF-CEM 1
21330014 10.1016/j.ejmech.2011.01.005 HeLa 1
21330014 10.1016/j.ejmech.2011.01.005 Human alphaherpesvirus 1 1
21330014 10.1016/j.ejmech.2011.01.005 Human alphaherpesvirus 2 1
21330014 10.1016/j.ejmech.2011.01.005 Vaccinia virus 1
21330014 10.1016/j.ejmech.2011.01.005 Human respirovirus 3 1
21330014 10.1016/j.ejmech.2011.01.005 Mammalian orthoreovirus 1 1
21330014 10.1016/j.ejmech.2011.01.005 Punta Toro virus 1
21330014 10.1016/j.ejmech.2011.01.005 Respiratory syncytial virus 1
21330014 10.1016/j.ejmech.2011.01.005 Sindbis virus 1

Data from ChEMBL 36 via Core Engine