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Compound Detail

CHEMBL219341

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O=c1[nH]c(=O)c2nn[nH]c2[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL219341
Phase Preclinical
Structure Type MOL
InChI Key KVGVQTOQSNJTJI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

153.1
MW (Da)
-1.67
ALogP
4
HBA
3
HBD
107.3
PSA (Ų)
0.42
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C4H3N5O2
MW 153.10
Aromatic Rings 2
Heavy Atoms 11
NP-Likeness -0.89

Literature References

PubMed DOI Target Context # Activities
17149876 10.1021/jm061012j Plasmodium falciparum 2
15686937 10.1016/j.bmcl.2004.12.003 Rattus norvegicus 1
17149876 10.1021/jm061012j Unchecked 1
20965617 10.1016/j.ejmech.2010.09.055 Unchecked 1

Data from ChEMBL 36 via Core Engine