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Compound Detail

CHEMBL353079

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Nc1ncnc2c1ncn2[C@H](C=O)OCC=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL353079
Phase Preclinical
Structure Type MOL
InChI Key WZPKZEDPVINBHB-LURJTMIESA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

235.2
MW (Da)
-0.68
ALogP
8
HBA
1
HBD
113.0
PSA (Ų)
0.68
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 C9H9N5O3
MW 235.20
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness 0.14

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
7401106 10.1021/jm00181a017 Adenosine deaminase 2

Data from ChEMBL 36 via Core Engine