GLUFOSINATE

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Synonyms
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 IAJOBQBIJHVGMQ-UHFFFAOYSA-N
Smiles CP(=O)(O)CCC(N)C(=O)O
InChI
InChI=1S/C5H12NO4P/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H12NO4P
Molecular Weight 181.13
AlogP -4.02
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 110.43
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 11.0
Assay Description Organism Bioactivity Reference
Inhibition of glutamine synthetase in glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) seedlings Lolium multiflorum 2432000.0 nM
Inhibition of glutamine synthetase in glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) seedlings Lolium multiflorum 137000.0 nM
Inhibition of glutamine synthetase in glufosinate-susceptible Lolium multiflorum C1 (Italian ryegrass) seedlings Lolium multiflorum 31000.0 nM
Induction of ammonia accumulation in glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 96 hr after compound treatment under greenhouse conditions (Rvb = 12.41 +/- 0.97 ug/g of leaves fresh weight) Lolium multiflorum 255.5 ug
Induction of ammonia accumulation in glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 72 hr after compound treatment under greenhouse conditions (Rvb = 12.41 +/- 0.97 ug/g of leaves fresh weight) Lolium multiflorum 212.3 ug
Induction of ammonia accumulation in glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 48 hr after compound treatment under greenhouse conditions (Rvb = 12.41 +/- 0.97 ug/g of leaves fresh weight) Lolium multiflorum 186.9 ug
Induction of ammonia accumulation in glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 24 hr after compound treatment under greenhouse conditions (Rvb = 12.41 +/- 0.97 ug/g of leaves fresh weight) Lolium multiflorum 164.8 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 96 hr after compound treatment under greenhouse conditions (Rvb = 14.79 +/- 4.09 ug/g of leaves fresh weight) Lolium multiflorum 384.5 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 72 hr after compound treatment under greenhouse conditions (Rvb = 14.79 +/- 4.09 ug/g of leaves fresh weight) Lolium multiflorum 353.1 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 48 hr after compound treatment under greenhouse conditions (Rvb = 14.79 +/- 4.09 ug/g of leaves fresh weight) Lolium multiflorum 320.2 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 24 hr after compound treatment under greenhouse conditions (Rvb = 14.79 +/- 4.09 ug/g of leaves fresh weight) Lolium multiflorum 243.8 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C1 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 96 hr after compound treatment under greenhouse conditions (Rvb = 11.04 +/- 0.89 ug/g of leaves fresh weight) Lolium multiflorum 427.9 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C1 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 72 hr after compound treatment under greenhouse conditions (Rvb = 11.04 +/- 0.89 ug/g of leaves fresh weight) Lolium multiflorum 332.2 ug
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum C1 (Italian ryegrass) seedlings at 3-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 48 hr after compound treatment under greenhouse conditions (Rvb = 11.04 +/- 0.89 ug/g of leaves fresh weight) Lolium multiflorum 304.4 ug
Resistance index, ratio of GR50 for glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) expressing one amino acid substitution in plastidic GS2 gene aspartic acid for asparagine at position 171 to GR50 for glufosinate-susceptible Lolium multiflorum (Italian ryegrass)C2 Lolium multiflorum 2.8
Resistance index, ratio of GR50 for glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) expressing one amino acid substitution in plastidic GS2 gene aspartic acid for asparagine at position 171 to GR50 for glufosinate-susceptible Lolium multiflorum (Italian ryegrass)C1 Lolium multiflorum 2.8
Herbicidal activity against glufosinate-resistant Lolium multiflorum MG (Italian ryegrass) expressing one amino acid substitution in plastidic GS2 gene aspartic acid for asparagine at position 171 assessed as reduction above-ground dry weight measured after 15 days post compound treatment under greenhouse conditions Lolium multiflorum 0.45 KgAi/ha
Herbicidal activity against glufosinate-susceptible Lolium multiflorum C2 (Italian ryegrass) assessed as reduction above-ground dry weight measured after 15 days post compound treatment under greenhouse conditions Lolium multiflorum 0.18 KgAi/ha
Induction of ammonia accumulation in glufosinate-susceptible Lolium multiflorum (Italian ryegrass) seedlings at three-leaf stage assessed as ammonia level per gram of leaves fresh weight at 0.4 kg Ai/ha measured 24 hr after compound treatment under greenhouse conditions (Rvb = 11.04 +/- 0.89 ug/g of leaves fresh weight) Lolium multiflorum 224.7 ug
Herbicidal activity against glufosinate-susceptible Lolium multiflorum C1 (Italian ryegrass) assessed as reduction above-ground dry weight measured after 15 days post compound treatment under greenhouse conditions Lolium multiflorum 0.15 KgAi/ha

Cross References

Resources Reference
ChEMBL CHEMBL450298
PubChem 5257279
SureChEMBL SCHEMBL17697
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