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Compound Detail

CHEMBL35150

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Cc1cn(COC(CO)CO)c(=O)nc1N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL35150
Phase Preclinical
Structure Type MOL
InChI Key VWWCOHBTFDLZBV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

229.2
MW (Da)
-1.54
ALogP
7
HBA
3
HBD
110.6
PSA (Ų)
0.56
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 C9H15N3O4
MW 229.24
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.25

Literature References

PubMed DOI Target Context # Activities
2826784 10.1021/jm00396a021 Human alphaherpesvirus 3 1
2826784 10.1021/jm00396a021 Cytomegalovirus 1
2826784 10.1021/jm00396a021 Human gammaherpesvirus 4 1

Data from ChEMBL 36 via Core Engine