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Compound Detail

CHEMBL2367979

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Nc1nc(O)c2ncn([C@H]3C=C(CO)[C@H](O)[C@@H]3O)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2367979
Phase Preclinical
Structure Type MOL
InChI Key RJYMIXUQPYIHLP-APQOSEDMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

279.3
MW (Da)
-1.69
ALogP
9
HBA
5
HBD
150.5
PSA (Ų)
0.41
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13N5O4
MW 279.26
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 0.68

Literature References

PubMed DOI Target Context # Activities
11689085 10.1021/jm010256v Human immunodeficiency virus 1 1
11689085 10.1021/jm010256v West Nile virus 1
11689085 10.1021/jm010256v ADMET 1
11689085 10.1021/jm010256v Vero 1
11689085 10.1021/jm010256v CCRF-CEM 1

Data from ChEMBL 36 via Core Engine