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Compound Detail

CHEMBL291874

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Cc1cn(COC(CO)CO)c2ncnc(N)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL291874
Phase Preclinical
Structure Type MOL
InChI Key MJYJIOHGOXHQBI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

252.3
MW (Da)
-0.35
ALogP
7
HBA
3
HBD
106.4
PSA (Ų)
0.67
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 C11H16N4O3
MW 252.27
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness 0.17

Literature References

PubMed DOI Target Context # Activities
2163454 10.1021/jm00169a028 L1210 2
2163454 10.1021/jm00169a028 Human betaherpesvirus 5 2
2163454 10.1021/jm00169a028 Human alphaherpesvirus 1 1
2163454 10.1021/jm00169a028 ADMET 1

Data from ChEMBL 36 via Core Engine