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Compound Detail

CHEMBL288351

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CN(C)c1ccn(COC(CO)CO)c(=O)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL288351
Phase Preclinical
Structure Type MOL
InChI Key XNEUMNNGSMGHSY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

243.3
MW (Da)
-1.36
ALogP
7
HBA
2
HBD
87.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H17N3O4
MW 243.26
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.06

Literature References

PubMed DOI Target Context # Activities
2826784 10.1021/jm00396a021 Human alphaherpesvirus 1 1
2826784 10.1021/jm00396a021 Human alphaherpesvirus 2 1
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