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 VAVHEWXMRGSNCR-DYTRJAOYSA-N
Smiles CNC(=O)\C(=N\OC)\c1ccccc1Oc2ccc(cc2)[Si](C)(C)C
InChI
InChI=1S/C19H24N2O3Si/c1-20-19(22)18(21-23-2)16-8-6-7-9-17(16)24-14-10-12-15(13-11-14)25(3,4)5/h6-13H,1-5H3,(H,20,22)/b21-18+

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H24N2O3Si
Molecular Weight 356.49
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None
Assay Description Organism Bioactivity Reference
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 125 ppm foliar application 24 hr after inoculation on upper surface of leaf by curative manner Pseudoperonospora cubensis None
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 31.3 ppm foliar application 24 hr after inoculation on upper surface of leaf by curative manner Pseudoperonospora cubensis None
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 7.8 ppm foliar application 24 hr after inoculation on upper surface of leaf by curative manner Pseudoperonospora cubensis None
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 2 ppm foliar application 24 hr after inoculation on upper surface of leaf by curative manner Pseudoperonospora cubensis None
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 125 ppm foliar application 24 hr after inoculation at 22 +/- 2 degC measured after 3 days by curative manner Botryotinia fuckeliana 50.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 31.3 ppm foliar application 24 hr after inoculation at 22 +/- 2 degC measured after 3 days by curative manner Botryotinia fuckeliana 50.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 7.8 ppm foliar application 24 hr after inoculation at 22 +/- 2 degC measured after 3 days by curative manner Botryotinia fuckeliana 50.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 2 ppm foliar application 24 hr after inoculation at 22 +/- 2 degC measured after 3 days by curative manner Botryotinia fuckeliana 50.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 125 ppm foliar application 24 hr after inoculation on upper surface of leaf at 23 +/- 2 degC by curative manner Podosphaera fuliginea 50.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 31.3 ppm foliar application 24 hr after inoculation on upper surface of leaf at 23 +/- 2 degC by curative manner Podosphaera fuliginea 50.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 7.8 ppm foliar application 24 hr after inoculation on upper surface of leaf at 23 +/- 2 degC by curative manner Podosphaera fuliginea 50.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 2 ppm foliar application 24 hr after inoculation on upper surface of leaf at 23 +/- 2 degC by curative manner Podosphaera fuliginea 50.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 10 ppm submerged application measured after 7 days Magnaporthe oryzae 50.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 2.5 ppm submerged application measured after 7 days Magnaporthe oryzae 50.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 0.63 ppm submerged application measured after 7 days Magnaporthe oryzae 50.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 0.16 ppm submerged application measured after 7 days Magnaporthe oryzae 50.0 %
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 125 ppm foliar application 24 hr before inoculation on upper surface of leaf by preventive manner Pseudoperonospora cubensis 70.0 %
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 31.3 ppm foliar application 24 hr before inoculation on upper surface of leaf by preventive manner Pseudoperonospora cubensis 70.0 %
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 7.8 ppm foliar application 24 hr before inoculation on upper surface of leaf by preventive manner Pseudoperonospora cubensis 70.0 %
Fungicidal activity against Pseudoperonospora cubensis assessed as cucumber downy mildew disease control at 2 ppm foliar application 24 hr before inoculation on upper surface of leaf by preventive manner Pseudoperonospora cubensis 70.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 125 ppm foliar application 24 hr before inoculation at 22 +/- 2 degC measured after 3 days by preventive manner Botryotinia fuckeliana 70.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 31.3 ppm foliar application 24 hr before inoculation at 22 +/- 2 degC measured after 3 days by preventive manner Botryotinia fuckeliana 70.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 7.8 ppm foliar application 24 hr before inoculation at 22 +/- 2 degC measured after 3 days by preventive manner Botryotinia fuckeliana 70.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as cucumber gray mold disease control at 2 ppm foliar application 24 hr before inoculation at 22 +/- 2 degC measured after 3 days by preventive manner Botryotinia fuckeliana 70.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 125 ppm foliar application 24 hr before inoculation on upper surface of leaf at 23 +/- 2 degC by preventive manner Podosphaera fuliginea 70.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 31.3 ppm foliar application 24 hr before inoculation on upper surface of leaf at 23 +/- 2 degC by preventive manner Podosphaera fuliginea 70.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 7.8 ppm foliar application 24 hr before inoculation on upper surface of leaf at 23 +/- 2 degC by preventive manner Podosphaera fuliginea 70.0 %
Fungicidal activity against Podosphaera fuliginea assessed as cucumber powdery mildew control under greenhouse at 2 ppm foliar application 24 hr before inoculation on upper surface of leaf at 23 +/- 2 degC by preventive manner Podosphaera fuliginea 70.0 %
Fungicidal activity against Thanatephorus cucumeris assessed as rice sheath blight disease control at 125 ppm foliar application for 24 hr before inoculation at 26 +- 2 measured after 5 days by preventive manner Thanatephorus cucumeris 70.0 %
Fungicidal activity against Thanatephorus cucumeris assessed as rice sheath blight disease control at 31.3 ppm foliar application for 24 hr before inoculation at 26 +- 2 measured after 5 days by preventive manner Thanatephorus cucumeris 70.0 %
Fungicidal activity against Thanatephorus cucumeris assessed as rice sheath blight disease control at 7.8 ppm foliar application for 24 hr before inoculation at 26 +- 2 measured after 5 days by preventive manner Thanatephorus cucumeris 70.0 %
Fungicidal activity against Thanatephorus cucumeris assessed as rice sheath blight disease control at 2 ppm foliar application for 24 hr before inoculation at 26 +- 2 measured after 5 days by preventive manner Thanatephorus cucumeris 70.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 125 ppm foliar application for 24 hr before inoculation at 27 +/- 2 degC measured after 5 days by preventive manner Magnaporthe oryzae 70.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 31.3 ppm foliar application for 24 hr before inoculation at 27 +/- 2 degC measured after 5 days by preventive manner Magnaporthe oryzae 70.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 7.8 ppm foliar application for 24 hr before inoculation at 27 +/- 2 degC measured after 5 days by preventive manner Magnaporthe oryzae 70.0 %
Fungicidal activity against Magnaporthe oryzae assessed as rice blast disease control at 2 ppm foliar application for 24 hr before inoculation at 27 +/- 2 degC measured after 5 days by preventive manner Magnaporthe oryzae 70.0 %

Cross References

Resources Reference
ChEMBL CHEMBL2288549
PubChem 19429876
SureChEMBL SCHEMBL8368514