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Compound Detail

CHEMBL2321911

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O=C(Nc1ccc(F)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Cl

Basic Information

ChEMBL ID CHEMBL2321911
Phase Preclinical
Structure Type MOL
InChI Key WPRZWFYFIWYTTL-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

329.1
MW (Da)
4.29
ALogP
3
HBA
1
HBD
72.2
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H7Cl2FN2O3
MW 329.11
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -2.61

Activity Summary

EC50 1 meas. best 6.02

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Trypanosoma brucei brucei
CHEMBL612851
EC50 6.02 6.02 950.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23484493 10.1021/jm301687p Trypanosoma brucei brucei 1

Data from ChEMBL 36 via Core Engine