METRIBUZIN

/static/temp/default.svg Search structure
UNII QO836138OV
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 FOXFZRUHNHCZPX-UHFFFAOYSA-N
Smiles CSC1=NN=C(C(=O)N1N)C(C)(C)C
InChI
InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H14N4OS
Molecular Weight 214.29
AlogP 1.61
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 96.35
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 14.0
Assay Description Organism Bioactivity Reference
Post-emergence herbicidal activity against isoproturon-resistant Phalaris minor infested wheat field assessed as reduction in weed dry weight at 280 g/ha applied on 1 after sowing through sprayer measured 120 days after sowing relative to control Phalaris minor 94.7 %
Herbicidal activity against Raphanus sativus var.Japanese White (radish) assessed as inhibition of seed germination at 200 ppm at 25 degC measured after 5 days Raphanus sativus 100.0 %
Herbicidal activity against Raphanus sativus var.Japanese White (radish) assessed as inhibition of seed germination at 100 ppm at 25 degC measured after 5 days Raphanus sativus 93.33 %
Herbicidal activity against Raphanus sativus var.Japanese White (radish) assessed as inhibition of seed germination at 50 ppm at 25 degC measured after 5 days Raphanus sativus 80.0 %
Herbicidal activity against Cyperus rotundus assessed as total dry weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Cyperus rotundus 3.32 MT/ha
Herbicidal activity against Malva sylvestris assessed as total dry weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Malva sylvestris 3.32 MT/ha
Herbicidal activity against Chenopodium murale assessed as total dry weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 4.1 MT/ha) Chenopodium murale 3.32 MT/ha
Herbicidal activity against Cyperus rotundus assessed as total fresh weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Cyperus rotundus 17.1 MT/ha
Herbicidal activity against Chenopodium murale assessed as total fresh weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Chenopodium murale 17.1 MT/ha
Herbicidal activity against Malva sylvestris assessed as total fresh weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 23.6 MT/ha) Malva sylvestris 17.1 MT/ha
Phytotoxicity in Allium cepa (onion) seedling assessed as total fresh weight at 0.35 kg/ha applied as spray before seed sowing (Rvb = 7.71 MT/ha) Allium cepa 7.64 MT/ha
Herbicidal activity against Chenopodium album at 125 g/ha after 3 weeks by post-emergence greenhouse test Chenopodium album None
Herbicidal activity against Stellaria media at 125 g/ha after 3 weeks by post-emergence greenhouse test Stellaria media 88.0 %
Herbicidal activity against Sinapis arvensis at 125 g/ha after 3 weeks by post-emergence greenhouse test Sinapis arvensis 100.0 %
Herbicidal activity against Matricaria chamomilla at 125 g/ha after 3 weeks by post-emergence greenhouse test Matricaria chamomilla 51.0 %
Herbicidal activity against Bromus tectorum at 125 g/ha after 3 weeks by post-emergence greenhouse test Bromus tectorum 1.0 %
Herbicidal activity against Alopecurus myosuroides at 125 g/ha after 3 weeks by post-emergence greenhouse test Alopecurus myosuroides 51.0 %
Herbicidal activity against Avena fatua at 125 g/ha after 3 weeks by post-emergence greenhouse test Avena fatua 0.0 %
Phytotoxic activity against Triticum aestivum (wheat) at 125 g/ha after 3 weeks by post-emergence greenhouse test Triticum aestivum 0.0 %
Herbicidal activity against Chenopodium album at 250 g/ha after 3 weeks by post-emergence greenhouse test Chenopodium album None
Herbicidal activity against Stellaria media at 250 g/ha after 3 weeks by post-emergence greenhouse test Stellaria media 100.0 %
Herbicidal activity against Sinapis arvensis at 250 g/ha after 3 weeks by post-emergence greenhouse test Sinapis arvensis 100.0 %
Herbicidal activity against Matricaria chamomilla at 250 g/ha after 3 weeks by post-emergence greenhouse test Matricaria chamomilla 100.0 %
Herbicidal activity against Bromus tectorum at 250 g/ha after 3 weeks by post-emergence greenhouse test Bromus tectorum 1.0 %
Herbicidal activity against Alopecurus myosuroides at 250 g/ha after 3 weeks by post-emergence greenhouse test Alopecurus myosuroides 51.0 %
Herbicidal activity against Avena fatua at 250 g/ha after 3 weeks by post-emergence greenhouse test Avena fatua 1.0 %
Phytotoxic activity against Triticum aestivum (wheat) at 250 g/ha after 3 weeks by post-emergence greenhouse test Triticum aestivum 1.0 %
Herbicidal activity against Chenopodium album at 500 g/ha after 3 weeks by post-emergence greenhouse test Chenopodium album None
Herbicidal activity against Stellaria media at 500 g/ha after 3 weeks by post-emergence greenhouse test Stellaria media 100.0 %
Herbicidal activity against Sinapis arvensis at 500 g/ha after 3 weeks by post-emergence greenhouse test Sinapis arvensis 100.0 %
Herbicidal activity against Bromus tectorum at 500 g/ha after 3 weeks by post-emergence greenhouse test Bromus tectorum 88.0 %
Herbicidal activity against Matricaria chamomilla at 500 g/ha after 3 weeks by post-emergence greenhouse test Matricaria chamomilla 100.0 %
Herbicidal activity against Alopecurus myosuroides at 500 g/ha after 3 weeks by post-emergence greenhouse test Alopecurus myosuroides 100.0 %
Herbicidal activity against Avena fatua at 500 g/ha after 3 weeks by post-emergence greenhouse test Avena fatua 76.0 %
Phytotoxic activity against Triticum aestivum (wheat) at 500 g/ha after 3 weeks by post-emergence greenhouse test Triticum aestivum 1.0 %

Cross References

Resources Reference
ChEMBL CHEMBL1902519
FDA SRS QO836138OV
PubChem 30479
SureChEMBL SCHEMBL66824
ZINC ZINC00039744
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