EDIFENPHOS

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Synonyms
UNII 770M9U0F8Q
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 AWZOLILCOUMRDG-UHFFFAOYSA-N
Smiles CCOP(=O)(Sc1ccccc1)Sc2ccccc2
InChI
InChI=1S/C14H15O2PS2/c1-2-16-17(15,18-13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12H,2H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H15O2PS2
Molecular Weight 310.37
AlogP 4.64
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 86.71
Molecular species None
Aromatic Rings 2.0
Heavy Atoms 19.0
Assay Description Organism Bioactivity Reference
Antifungal activity against drug-resistant Magnaporthe oryzae infected six-leaf stage of rice plant assessed as reduction of susceptible lesion number per leaf area at 2 time MIC treated 24 hr before fungal infection measured after 6 days relative to control Magnaporthe oryzae 20.5 %
Antifungal activity against drug-resistant Magnaporthe oryzae infected six-leaf stage of rice plant assessed as reduction of disease recovery at 2 time MIC treated 24 hr before fungal infection measured after 6 days relative to control Magnaporthe oryzae 20.0 %
Antifungal activity against drug-sensitive Magnaporthe oryzae infected six-leaf stage of rice plant assessed as reduction of susceptible lesion number per leaf area at 2 time MIC treated 24 hr before fungal infection measured after 6 days relative to control Magnaporthe oryzae 63.5 %
Antifungal activity against drug-sensitive Magnaporthe oryzae infected six-leaf stage of rice plant assessed as reduction of disease recovery at 2 time MIC treated 24 hr before fungal infection measured after 6 days relative to control Magnaporthe oryzae 55.6 %
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area at 8 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.03 cm2
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area at 4 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.07 cm2
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area at 2 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.14 cm2
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area at MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.19 cm2
Antifungal activity against drug-sensitive Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.1 cm2
Antifungal activity against drug-resistant Magnaporthe oryzae KJ113 assessed as inhibition of mycelial growth Magnaporthe oryzae 9.94 ug.mL-1
Antifungal activity against drug-resistant Magnaporthe oryzae IC115 assessed as inhibition of mycelial growth Magnaporthe oryzae 9.44 ug.mL-1
Antifungal activity against drug-resistant Magnaporthe oryzae IC068 assessed as inhibition of mycelial growth Magnaporthe oryzae 9.91 ug.mL-1
Antifungal activity against drug-resistant Magnaporthe oryzae DH189 assessed as inhibition of mycelial growth Magnaporthe oryzae 7.93 ug.mL-1
Antifungal activity against drug-sensitive Magnaporthe oryzae KH144 assessed as inhibition of mycelial growth Magnaporthe oryzae 3.58 ug.mL-1
Antifungal activity against drug-sensitive Magnaporthe oryzae IC029 assessed as inhibition of mycelial growth Magnaporthe oryzae 5.84 ug.mL-1
Antifungal activity against drug-sensitive Magnaporthe oryzae HM036 assessed as inhibition of mycelial growth Magnaporthe oryzae 2.41 ug.mL-1
Antifungal activity against drug-sensitive Magnaporthe oryzae HM025 assessed as inhibition of mycelial growth Magnaporthe oryzae 2.97 ug.mL-1
Antifungal activity against drug-resistant Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.43 %
Antifungal activity against drug-sensitive Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.27 %
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery at MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.49 %
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery at 2 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.35 %
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery at 4 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.18 %
Antifungal activity against Magnaporthe oryzae infected six-leaf stage of rice plant assessed as disease recovery at 8 time MIC treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.08 %
Antifungal activity against drug-resistant Magnaporthe oryzae infected six-leaf stage of rice plant assessed susceptible lesion number per leaf area treated 24 hr before fungal infection measured after 24 hr Magnaporthe oryzae 0.2 cm2
Fungicidal activity against Magnaporthe grisea P-2 assessed as inhibition of appressorium formation at 10 ug/ml Magnaporthe grisea None
Fungicidal activity against Magnaporthe grisea P-2 assessed as inhibition of appressorium formation at 1 ug/ml Magnaporthe grisea 44.8 %
Fungicidal activity against Magnaporthe grisea P-2 assessed as inhibition of spore germination at 10 ug/ml Magnaporthe grisea 100.0 %
Fungicidal activity against Magnaporthe grisea P-2 assessed as inhibition of spore germination at 1 ug/ml Magnaporthe grisea 76.4 %

Cross References

Resources Reference
ChEMBL CHEMBL1671900
FDA SRS 770M9U0F8Q
PubChem 28292
SureChEMBL SCHEMBL20330
ZINC ZINC02018150
CONTENTS