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 FZIOXGIYHUQMMX-UHFFFAOYSA-N
Smiles C[Si](C)(C)CC(Cn1cncn1)(C#N)c2ccc(F)cc2
InChI
InChI=1S/C15H19FN4Si/c1-21(2,3)10-15(8-17,9-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,9-10H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H19FN4Si
Molecular Weight 302.42
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
Antifungal activity against Podosphaera fuliginea infected compound-pre-treated cucumber seedlings at 300 ppm incubated for 2 days prior to infection measured after 4 days relative to buthiobate Podosphaera fuliginea 0.0
Antifungal activity against Rhizoctonia solani infected compound-pre-treated rice seedlings at 300 ppm incubated for 2 days prior to infection measured after 4 days relative to diclomezine Rhizoctonia solani 2.0

Cross References

Resources Reference
ChEMBL CHEMBL2251997
SureChEMBL SCHEMBL9053196