IMAZAMOX

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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 NUPJIGQFXCQJBK-UHFFFAOYSA-N
Smiles COCc1cnc(C2=NC(C)(C(C)C)C(=O)N2)c(c1)C(=O)O
InChI
InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H19N3O4
Molecular Weight 305.33
AlogP 1.12
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 100.88
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 22.0
Assay Description Organism Bioactivity Reference
Herbicidal activity against feral Secale cereale (rye) treated as spring post-emergence application at winter wheat-growing season in presence of urea ammonium nitrate Secale cereale None
Herbicidal activity against feral Secale cereale (rye) treated as fall post-emergence application at winter wheat-growing season in presence of urea ammonium nitrate Secale cereale None
Herbicidal activity against Aegilops cylindrica treated as spring post-emergence application at winter wheat-growing season relative to urea ammonium nitrate Aegilops cylindrica None
Herbicidal activity against Aegilops cylindrica treated as fall post-emergence application at winter wheat-growing season relative to urea ammonium nitrate Aegilops cylindrica None
Herbicidal activity against Avena sterilis accession P21S assessed as weed survival at 1/32 times field recommended herbicide dose Avena sterilis 100.0 %
Herbicidal activity against Avena sterilis accession P19S assessed as weed survival at 1/32 times field recommended herbicide dose Avena sterilis 100.0 %
Herbicidal activity against Avena sterilis accession P13S assessed as weed survival at 1/32 times field recommended herbicide dose Avena sterilis 100.0 %
Herbicidal activity against Avena sterilis accession P10S assessed as weed survival at 1/32 times field recommended herbicide dose Avena sterilis 100.0 %
Herbicidal activity against Avena sterilis accession P06S assessed as weed survival at 1/32 times field recommended herbicide dose Avena sterilis 97.0 %
Herbicidal activity against Avena sterilis accession P22 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P20 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P18 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P17 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P16 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P15 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P14 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P12 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P11 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P09 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P08 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P07 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P05 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P04 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P03 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P02 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P01 assessed as weed survival at 32 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P21S assessed as weed survival at 1/16 times field recommended herbicide dose Avena sterilis 97.0 %
Herbicidal activity against Avena sterilis accession P19S assessed as weed survival at 1/16 times field recommended herbicide dose Avena sterilis 97.0 %
Herbicidal activity against Avena sterilis accession P13S assessed as weed survival at 1/16 times field recommended herbicide dose Avena sterilis 80.0 %
Herbicidal activity against Avena sterilis accession P10S assessed as weed survival at 1/16 times field recommended herbicide dose Avena sterilis 80.0 %
Herbicidal activity against Avena sterilis accession P06S assessed as weed survival at 1/16 times field recommended herbicide dose Avena sterilis 93.0 %
Herbicidal activity against Avena sterilis accession P22 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P20 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P18 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P17 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P16 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P15 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P14 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P12 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P11 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P09 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P08 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P07 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P05 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P04 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P03 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P02 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P01 assessed as weed survival at 16 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P21S assessed as weed survival at 1/8 times field recommended herbicide dose Avena sterilis 87.0 %
Herbicidal activity against Avena sterilis accession P19S assessed as weed survival at 1/8 times field recommended herbicide dose Avena sterilis 80.0 %
Herbicidal activity against Avena sterilis accession P13S assessed as weed survival at 1/8 times field recommended herbicide dose Avena sterilis 50.0 %
Herbicidal activity against Avena sterilis accession P10S assessed as weed survival at 1/8 times field recommended herbicide dose Avena sterilis 60.0 %
Herbicidal activity against Avena sterilis accession P06S assessed as weed survival at 1/8 times field recommended herbicide dose Avena sterilis 57.0 %
Herbicidal activity against Avena sterilis accession P22 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P20 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P18 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P17 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P16 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P15 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P14 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P12 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P11 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P09 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P08 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P07 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P05 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P04 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P03 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P02 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P01 assessed as weed survival at 8 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P21S assessed as weed survival at 1/4 times field recommended herbicide dose Avena sterilis 60.0 %
Herbicidal activity against Avena sterilis accession P19S assessed as weed survival at 1/4 times field recommended herbicide dose Avena sterilis 60.0 %
Herbicidal activity against Avena sterilis accession P13S assessed as weed survival at 1/4 times field recommended herbicide dose Avena sterilis 40.0 %
Herbicidal activity against Avena sterilis accession P10S assessed as weed survival at 1/4 times field recommended herbicide dose Avena sterilis 20.0 %
Herbicidal activity against Avena sterilis accession P06S assessed as weed survival at 1/4 times field recommended herbicide dose Avena sterilis 40.0 %
Herbicidal activity against Avena sterilis accession P22 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P20 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P17 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P18 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P16 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P15 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P14 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P12 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P11 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P09 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P08 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P05 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P07 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P04 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P03 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P02 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P01 assessed as weed survival at 4 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P21S assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P19S assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P13S assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P10S assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P22 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P06S assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P20 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P18 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P17 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 3.0 %
Herbicidal activity against Avena sterilis accession P16 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P15 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P14 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P12 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P09 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P11 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P08 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 3.0 %
Herbicidal activity against Avena sterilis accession P07 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P05 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P04 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 3.0 %
Herbicidal activity against Avena sterilis accession P03 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P02 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 3.0 %
Herbicidal activity against Avena sterilis accession P01 assessed as weed survival at 1 times field recommended herbicide dose Avena sterilis 0.0 %
Herbicidal activity against Avena sterilis accession P21S assessed as induction of weed mortality Avena sterilis 14.0 gAi/ha
Herbicidal activity against Avena sterilis accession P19S assessed as induction of weed mortality Avena sterilis 14.0 gAi/ha
Herbicidal activity against Avena sterilis accession P10S assessed as induction of weed mortality Avena sterilis 7.0 gAi/ha
Herbicidal activity against Avena sterilis accession P13S assessed as induction of weed mortality Avena sterilis 8.0 gAi/ha
Herbicidal activity against Avena sterilis accession P06S assessed as induction of weed mortality Avena sterilis 9.0 gAi/ha
Herbicidal activity against Avena sterilis accession P22 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P20 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P17 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P18 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P16 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P15 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P14 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P11 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P12 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P09 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P08 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P07 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P04 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P05 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P03 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P02 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against Avena sterilis accession P01 assessed as induction of weed mortality Avena sterilis 50.0 gAi/ha
Herbicidal activity against two to three-leaf stage ALS-herbicide-susceptible Raphanus raphanistrum WARR7 (wild radish) assessed as reduction in survival at 62 g/ha measured 3 weeks after compound treatment Raphanus raphanistrum None
Herbicidal activity against two to three-leaf stage ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant assessed as reduction in survival at 1600 g/ha measured 3 weeks after compound treatment Raphanus raphanistrum 20.0 %
Inhibition of ALS in ALS-herbicide-susceptible Raphanus raphanistrum WARR33 (wild radish) Raphanus raphanistrum 4776.0 nM
Resistance index, ratio of I50 for ALS Ala122Tyr mutant in ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant to I50 for ALS-herbicide-susceptible Raphanus raphanistrum (wild radish) Raphanus raphanistrum 21.0
Inhibition of ALS in ALS-herbicide-susceptible Raphanus raphanistrum WARR7 (wild radish) Raphanus raphanistrum 4776.0 nM
Inhibition of ALS Ala122Tyr mutant in ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant Raphanus raphanistrum 100000.0 nM
Resistance index, ratio of GR50 for ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant to GR50 for ALS-herbicide-susceptible Raphanus raphanistrum (wild radish) WARR7 Raphanus raphanistrum 256.0
Herbicidal activity against two to three leaf stage ALS-herbicide-susceptible Raphanus raphanistrum WARR7 (wild radish) assessed as reduction in dry weight of above-ground biomass measured 3 weeks after compound treatment Raphanus raphanistrum 6.3 g/ha
Herbicidal activity against two to three leaf stage ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant assessed as reduction in dry weight of above-ground biomass measured 3 weeks after compound treatment Raphanus raphanistrum 1600.0 g/ha
Resistance index, ratio of LD50 for ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant to LD50 for ALS-herbicide-susceptible Raphanus raphanistrum (wild radish) WARR7 Raphanus raphanistrum 137.0
Herbicidal activity against two to three leaf stage ALS-herbicide-susceptible Raphanus raphanistrum WARR7 (wild radish) assessed as reduction in survival measured 3 weeks after compound treatment Raphanus raphanistrum 11.7 g/ha
Herbicidal activity against two to three leaf stage ALS-herbicide-resistant Raphanus raphanistrum WARR30 (wild radish) expressing ALS Ala122Tyr mutant assessed as reduction in survival measured 3 weeks after compound treatment Raphanus raphanistrum 1600.0 g/ha

Cross References

Resources Reference
ChEMBL CHEMBL1881028
PubChem 86137
SureChEMBL SCHEMBL18640
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