Synonyms
Molecule Category Free-form
UNII C8BX46QL7K
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 ZSDSQXJSNMTJDA-UHFFFAOYSA-N
Smiles CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H16F3N3O4
Molecular Weight 335.28
AlogP 4.47
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 8.0
Polar Surface Area 94.88
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 23.0
Assay Description Organism Bioactivity Reference
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Eleusine indica 15.9 tons/ha
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Digitaria 15.9 tons/ha
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Echinochloa colona 15.9 tons/ha
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Amaranthus 15.9 tons/ha
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Boerhavia erecta 15.9 tons/ha
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Cleome viscosa 15.9 tons/ha
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Portulaca oleracea 15.9 tons/ha
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as total fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 13.7 t/ha) Trianthema 15.9 tons/ha
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Eleusine indica 9.6 tons/ha
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Digitaria 9.6 tons/ha
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Echinochloa colona 9.6 tons/ha
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Amaranthus 9.6 tons/ha
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Boerhavia erecta 9.6 tons/ha
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Cleome viscosa 9.6 tons/ha
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Portulaca oleracea 9.6 tons/ha
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as extra-large fruit weight at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 7.3 t/ha) Trianthema 9.6 tons/ha
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Eleusine indica 59.5 tons/ha
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Digitaria 59.5 tons/ha
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Echinochloa colona 59.5 tons/ha
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Amaranthus 59.5 tons/ha
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Boerhavia erecta 59.5 tons/ha
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Cleome viscosa 59.5 tons/ha
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Portulaca oleracea 59.5 tons/ha
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as total number of fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 49.5 x 10 '3 ha) Trianthema 59.5 tons/ha
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Eleusine indica 29.5 tons/ha
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Digitaria 29.5 tons/ha
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Echinochloa colona 29.5 tons/ha
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Amaranthus 29.5 tons/ha
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Boerhavia erecta 29.5 tons/ha
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Cleome viscosa 29.5 tons/ha
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Portulaca oleracea 29.5 tons/ha
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as number of extra-large fruits at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting (Rvb = 21.3 x 10 '3 ha) Trianthema 29.5 tons/ha
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Eleusine indica 7.0 /m2
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Digitaria 7.0 /m2
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Echinochloa colona 7.0 /m2
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Amaranthus 7.0 /m2
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Boerhavia erecta 7.0 /m2
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Cleome viscosa 7.0 /m2
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Portulaca oleracea 7.0 /m2
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 9 plants/m2) Trianthema 7.0 /m2
Pre-emergence herbicidal activity against Cyperus in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 5 plants/m2) Cyperus 8.0 /m2
Pre-emergence herbicidal activity against Poaceae (grass family) in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 12 weeks after treatment (Rvb = 8 plants/m2) Poaceae 5.0 /m2
Pre-emergence herbicidal activity against Eleusine indica in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Eleusine indica 10.0 /m2
Pre-emergence herbicidal activity against Digitaria spp. in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Digitaria 10.0 /m2
Pre-emergence herbicidal activity against Echinochloa colona in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Echinochloa colona 10.0 /m2
Pre-emergence herbicidal activity against Amaranthus dubius in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Amaranthus 10.0 /m2
Pre-emergence herbicidal activity against Boerhavia erecta in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Boerhavia erecta 10.0 /m2
Pre-emergence herbicidal activity against Cleome viscosa in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Cleome viscosa 10.0 /m2
Pre-emergence herbicidal activity against Portulaca oleracea in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Portulaca oleracea 10.0 /m2
Pre-emergence herbicidal activity against Trianthema spp. in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 9 plants/m2) Trianthema 10.0 /m2
Pre-emergence herbicidal activity against Cyperus in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 3 plants/m2) Cyperus 5.0 /m2
Pre-emergence herbicidal activity against Poaceae (grass family) in tomato field assessed as number of weeds at 0.80 kg/ha applied through drip lines/backpack-spray on week 3 to 4 before transplanting measured 7 weeks after treatment (Rvb = 6 plants/m2) Poaceae 6.0 /m2
Phytotoxicity against Sesamum indicum (sesame) plant assessed as yield at 1.68 kg/ha applied using mixing wheel cultivator (Rvb = 333 kg/ha) Sesamum indicum 406.0 kg/ha
Phytotoxicity against Sesamum indicum (sesame) plant assessed as yield at 0.84 kg/ha applied using mixing wheel cultivator (Rvb = 333 kg/ha) Sesamum indicum 342.0 kg/ha
Phytotoxicity against Sesamum indicum (sesame) plant assessed as yield at 0.42 kg/ha applied using mixing wheel cultivator (Rvb = 333 kg/ha) Sesamum indicum 587.0 kg/ha
Phytotoxicity against Sesamum indicum (sesame) plant assessed as stunt in growth at 1.68 kg/ha applied using mixing wheel cultivator (Rvb = 0%) Sesamum indicum 4.0 %
Phytotoxicity against Sesamum indicum (sesame) plant assessed as stunt in growth at 0.84 kg/ha applied using mixing wheel cultivator (Rvb = 0%) Sesamum indicum 2.0 %
Phytotoxicity against Sesamum indicum (sesame) plant assessed as stunt in growth at 0.42 kg/ha applied using mixing wheel cultivator (Rvb = 0%) Sesamum indicum 0.0 %
Phytotoxicity against Sesamum indicum (sesame) plant assessed as sesame stand at 1.68 kg/ha applied using mixing wheel cultivator relative to control Sesamum indicum 67.0 %
Phytotoxicity against Sesamum indicum (sesame) plant assessed as sesame stand at 0.84 kg/ha applied using mixing wheel cultivator relative to control Sesamum indicum 76.0 %
Phytotoxicity against Sesamum indicum (sesame) plant assessed as sesame stand at 0.42 kg/ha applied using mixing wheel cultivator relative to control Sesamum indicum 99.0 %
Herbicidal activity against Urochloa platyphylla at 1.68 kg/ha applied using mixing wheel cultivator Urochloa platyphylla 96.0 %
Herbicidal activity against Urochloa platyphylla at 0.84 kg/ha applied using mixing wheel cultivator Urochloa platyphylla 91.0 %
Herbicidal activity against Urochloa platyphylla at 0.42 kg/ha applied using mixing wheel cultivator Urochloa platyphylla 86.0 %
Herbicidal activity against Amaranthus tuberculatus at 1.68 kg/ha applied using mixing wheel cultivator Amaranthus tuberculatus 92.0 %
Herbicidal activity against Amaranthus tuberculatus at 0.84 kg/ha applied using mixing wheel cultivator Amaranthus tuberculatus 85.0 %
Herbicidal activity against Amaranthus tuberculatus at 0.42 kg/ha applied using mixing wheel cultivator Amaranthus tuberculatus 90.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated rate of oxygen evolution per mg of chloroplast at 62.5 uM preincubated with DTT in dark condition for 5 min presence of 0.31 mM DTT Spinacia oleracea 60.0 umol/hr
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated rate of oxygen evolution per mg of chloroplast at 62.5 uM Spinacia oleracea 62.0 umol/hr
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated rate of oxygen evolution per mg of chloroplast at 62.5 uM in presence of 0.31 mM DTT Spinacia oleracea 64.0 umol/hr
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated sulfhydryl-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM treated during activation stage Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated sulfhydryl-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM treated during incubation stage Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated Mg2+-ATPase activity assessed as inorganic phosphate release Spinacia oleracea 90000.0 nM
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated light-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM treated during incubation stage Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated light-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM treated during activation stage Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated sulfhydryl-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated light-induced ATP-Pi exchange assessed as inorganic phosphate release at 200 uM Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated sulfhydryl-induced ATP-Pi exchange assessed as inorganic phosphate release Spinacia oleracea 20000.0 nM
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated light-induced ATP-Pi exchange assessed as inorganic phosphate release Spinacia oleracea 20000.0 nM
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation up to 200 uM by polarographically in presence of ascorbate in red light Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation up to 200 uM by polarographically in absence of DCMU in red light Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation up to 200 uM by polarographically in absence of DCMU in white light Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation at 200 uM by polarographically Spinacia oleracea 6.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation at 100 uM by polarographically Spinacia oleracea 17.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation at 50 uM by polarographically Spinacia oleracea 28.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation at 25 uM by polarographically Spinacia oleracea 24.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated DAD-induced cyclic phosphorylation at 10 uM by polarographically Spinacia oleracea 6.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated PMS-induced cyclic phosphorylation at 200 uM by polarographically Spinacia oleracea 20.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated PMS-induced cyclic phosphorylation at 100 uM by polarographically Spinacia oleracea 16.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated PMS-induced cyclic phosphorylation at 50 uM by polarographically Spinacia oleracea 18.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated PMS-induced cyclic phosphorylation at 25 uM by polarographically Spinacia oleracea 16.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated PMS-induced cyclic phosphorylation at 10 uM by polarographically Spinacia oleracea 4.0 %
Inhibition of Spinacia oleracea (spinach) photosystem II mediated noncyclic photophosphorylation assessed as 32P-orthophosphate incorporation into ATP up to 300 uM by polarographically Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) photosystem I mediated noncyclic photophosphorylation assessed as 32P-orthophosphate incorporation into ATP up to 300 uM by polarographically Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated noncyclic photophosphorylation assessed as 32P-orthophosphate incorporation into ATP by polarographically Spinacia oleracea 50000.0 nM
Inhibition of Spinacia oleracea (spinach) photosystem II assessed as light-induced re-reduction of Cyt-f at 200 uM added prior to illumination by dual wavelength spectrophotometer analysis Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) photosystem I assessed as light-induced oxidation of Cyt-f at 200 uM added prior to illumination by dual wavelength spectrophotometer analysis Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) photosystem II assessed as electron flow from H20 to PDOX at 300 uM after 1 hr by polarographically Spinacia oleracea 50.0 %
Inhibition of Spinacia oleracea (spinach) photosystem I assessed as electron flow from ascorbate/DAD to methylviologen at >200 uM after 1 hr by polarographically Spinacia oleracea None
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain assessed as residual activity of noncyclic electron flow using methylviologen as acceptor up to 300 uM by polarographically relative to control Spinacia oleracea 10.0 %
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain-mediated noncyclic electron flow using methylviologen as acceptor by polarographically Spinacia oleracea 10000.0 nM
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain assessed as electron flow from water to ferricyanide by polarographically Spinacia oleracea 10000.0 nM
Inhibition of Spinacia oleracea (spinach) chloroplast electron transport chain assessed as residual electron flow from water to ferricyanide up to 300 uM by polarographically relative to control Spinacia oleracea 10.0 %
Hydrophobicity, log P of the compound in octanol-water by shaking-flask method None 5.07
Herbicidal activity against Cyperus rotundus assessed as total dry weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Cyperus rotundus 2.69 MT/ha
Herbicidal activity against Malva sylvestris assessed as total dry weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Malva sylvestris 2.69 MT/ha
Herbicidal activity against Chenopodium murale assessed as total dry weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Chenopodium murale 2.69 MT/ha
Herbicidal activity against Malva sylvestris assessed as total fresh weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Malva sylvestris 14.8 MT/ha
Herbicidal activity against Cyperus rotundus assessed as total fresh weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Cyperus rotundus 14.8 MT/ha
Herbicidal activity against Chenopodium murale assessed as total fresh weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Chenopodium murale 14.8 MT/ha
Phytotoxicity in Allium cepa (onion) seedling assessed as total fresh weight at 0.86 kg/ha applied as spray before seed sowing (Rvb = 7.71 MT/ha) Allium cepa 7.04 MT/ha
Toxicity against Bionectria ochroleuca assessed as inhibition of mycelial growth at 0.009 to 0.055 ug/ml Bionectria ochroleuca 3.6 %
Toxicity against Bionectria ochroleuca assessed as inhibition of conidial germination at 0.009 to 0.055 ug/ml Bionectria ochroleuca 2.2 %

Cross References

Resources Reference
ChEMBL CHEMBL31970
FDA SRS C8BX46QL7K
PubChem 5569
SureChEMBL SCHEMBL21994
ZINC ZINC03873953