FLUAZINAM

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UNII 0P91PCK33Q
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key UZCGKGPEKUCDTF-UHFFFAOYSA-N
Smiles [O-][N+](=O)c1cc(c(Cl)c(c1Nc2ncc(cc2Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F
InChI
InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H4Cl2F6N4O4
Molecular Weight 465.09
AlogP 5.77
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 6.0
Polar Surface Area 116.56
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 29.0
Assay Description Organism Bioactivity Reference
Protective effect against Rhizoctonia solani AG-1 IA infected soybean plant at 750 g a.i/ha applied as spray at V5 to V6 growth stage prior to inoculation measured after 5 to 10 days under greenhouse condition relative to control Rhizoctonia solani AG-1 IA None
Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as inhibition of mycelial radial growth Rhizoctonia solani AG-1 IA 2.28 mg/L Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as inhibition of mycelial radial growth Rhizoctonia solani AG-1 IA 0.046 ug.mL-1
Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as mycelial radial growth at 100 mg/l (Rvb = 40 mm) Rhizoctonia solani AG-1 IA 3.4 mm
Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as mycelial radial growth at 1 mg/l (Rvb = 40 mm) Rhizoctonia solani AG-1 IA 5.1 mm
Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as mycelial radial growth at 10 mg/l (Rvb = 40 mm) Rhizoctonia solani AG-1 IA 4.3 mm
Fungicidal activity against Rhizoctonia solani AG-1 IA assessed as mycelial radial growth at 0.1 mg/l (Rvb = 40 mm) Rhizoctonia solani AG-1 IA 9.1 mm
Fungicidal activity against Macrophomina phaseolina assessed as mycelial growth inhibition incubated at 27 degC for 5 days Macrophomina phaseolina 0.01 mg.kg-1
Fungicidal activity against Macrophomina phaseolina in non-grafted Melon plants cv. 6405 plots assessed as disease incidence exposed to compound at 200 ml/1000 m2 of commercial product applied as soil drench three times during growing season (Rvb = 65%) Macrophomina phaseolina 35.0 mg.kg-1
Antifungal activity against circular leaf spot causing Mycosphaerella nawae MY1 assessed as inhibition of mycelial growth on potato dextrose agar Mycosphaerella nawae 24.0 ug.mL-1
Antifungal activity against circular leaf spot causing Mycosphaerella nawae MY5 assessed as inhibition of mycelial growth on potato dextrose agar Mycosphaerella nawae 50.6 ug.mL-1
Fungicidal activity against Botryotinia fuckeliana inoculated on compound pre-treated one-leaf stage cucumber seedlings assessed as prevention of leaf lesions measured 3 days after inoculation Botryotinia fuckeliana 16.0 ppm
Antifungal activity against Botryotinia fuckeliana in Kidney bean assessed as Kidney bean gray mold diseased pods in field trials at 500 ug/ml 3 applications at 9 days intervals (Rvb = 21%) Botryotinia fuckeliana 7.8 %
Antifungal activity against Botryotinia fuckeliana in Eggplant seedlings assessed as Eggplant gray mold diseased flowers and fruits in field trials at 500 ug/ml 3 applications at 7 days intervals (Rvb = 52.7%) Botryotinia fuckeliana None
Fungicidal activity against Rhizoctonia solani assessed as SH-inhibition Rhizoctonia solani None
Fungicidal activity against Podosphaera fuliginea assessed as SH-inhibition Podosphaera fuliginea None
Fungicidal activity against Botryotinia fuckeliana assessed as SH-inhibition Botryotinia fuckeliana None
Fungicidal activity against Magnaporthe oryzae assessed as SH-inhibition Magnaporthe oryzae None
Inhibition of mitochondrial uncoupling in Rattus norvegicus (rat) Rattus norvegicus None
Fungicidal activity against Rhizoctonia solani assessed as mitochondrial uncoupling activity Rhizoctonia solani None
Fungicidal activity against Podosphaera fuliginea assessed as mitochondrial uncoupling activity Podosphaera fuliginea None
Fungicidal activity against Botryotinia fuckeliana assessed as mitochondrial uncoupling activity Botryotinia fuckeliana None
Fungicidal activity against Magnaporthe oryzae assessed as mitochondrial uncoupling activity Magnaporthe oryzae None
Fungicidal activity against Podosphaera fuliginea infected in 24 hr compound pre-treated cucumber plant assessed as disease control measured after 10 days Podosphaera fuliginea 63.0 ppm
Fungicidal activity against Magnaporthe oryzae infected in 24 hr compound pre-treated Oryza sativa cv. Chukyoasahi assessed as disease control measured after 10 days Magnaporthe oryzae 16.0 ppm

Cross References

Resources Reference
ChEMBL CHEMBL1878267
FDA SRS 0P91PCK33Q
PubChem 91731
SureChEMBL SCHEMBL22373
ZINC ZINC13827765
CONTENTS