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Compound Detail

CHEMBL303191

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N#Cc1cn(COCCO)c2nc(N)nc(O)c12

Basic Information

ChEMBL ID CHEMBL303191
Phase Preclinical
Structure Type MOL
InChI Key YTXJFKGPFBCZAQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

249.2
MW (Da)
-0.44
ALogP
8
HBA
3
HBD
130.2
PSA (Ų)
0.63
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H11N5O3
MW 249.23
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
2165163 10.1021/jm00170a019 Human immunodeficiency virus 1

Data from ChEMBL 36 via Core Engine