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Compound Detail

CHEMBL1668879

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Cn1c([N+](=O)[O-])cnc1COc1ccncc1

Basic Information

ChEMBL ID CHEMBL1668879
Phase Preclinical
Structure Type MOL
InChI Key VQCLPNAACXAPSZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

234.2
MW (Da)
1.30
ALogP
6
HBA
0
HBD
83.1
PSA (Ų)
0.59
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 C10H10N4O3
MW 234.22
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.68

Literature References

PubMed DOI Target Context # Activities
21211967 10.1016/j.bmcl.2010.12.040 No relevant target 2
21211967 10.1016/j.bmcl.2010.12.040 Trypanosoma brucei rhodesiense 1
21211967 10.1016/j.bmcl.2010.12.040 L6 1

Data from ChEMBL 36 via Core Engine