METALAXYL

/static/temp/default.svg Search structure
Synonyms
Molecule Category Free-form
UNII 16K4M187IF
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 ZQEIXNIJLIKNTD-UHFFFAOYSA-N
Smiles COCC(=O)N(C(C)C(=O)OC)c1c(C)cccc1C
InChI
InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H21NO4
Molecular Weight 279.33
AlogP 2.06
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 55.84
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 20.0
Assay Description Organism Bioactivity Reference
Antifungal activity against Phytophthora sojae race 1 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 6.82 mg/L Antifungal activity against Phytophthora sojae race 1 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.35 ug.mL-1
Antifungal activity against Phytophthora sojae race 3 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 4.63 mg/L Antifungal activity against Phytophthora sojae race 3 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.17 ug.mL-1
Antifungal activity against Phytophthora sojae race 4 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 8.03 mg/L Antifungal activity against Phytophthora sojae race 4 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.18 ug.mL-1
Antifungal activity against Phytophthora sojae race 5 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 11.58 mg/L Antifungal activity against Phytophthora sojae race 5 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.3 ug.mL-1
Antifungal activity against Phytophthora sojae race 9 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 11.81 mg/L Antifungal activity against Phytophthora sojae race 9 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.34 ug.mL-1
Antifungal activity against Phytophthora sojae race 13 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 7.55 mg/L Antifungal activity against Phytophthora sojae race 13 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.32 ug.mL-1
Antifungal activity against Phytophthora sojae race 44 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 12.25 mg/L Antifungal activity against Phytophthora sojae race 44 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.28 ug.mL-1
Antifungal activity against Phytophthora sojae race 54 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 13.28 mg/L Antifungal activity against Phytophthora sojae race 54 assessed as growth inhibition at 28 degC after 7 days (beneficial crop soybean) Phytophthora sojae 0.3 ug.mL-1
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as root length at 4 mg/L after 48 hr compound at 25% WP (untreated control = 4.15 +/- 0.71 cm) Phytophthora sojae 6.21 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as root length at 20 mg/L after 48 hr compound at 25% WP (untreated control = 4.15 +/- 0.71 cm) Phytophthora sojae 6.48 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as root length at 40 mg/L after 48 hr compound at 25% WP (untreated control = 4.15 +/- 0.71 cm) Phytophthora sojae 6.73 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as lesion length at 4 mg/L after 48 hr compound at 25% WP (untreated control = 3.34 +/- 0.64 cm) Phytophthora sojae 2.57 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as lesion length at 20 mg/L after 48 hr compound at 25% WP (untreated control = 3.34 +/- 0.64 cm) Phytophthora sojae 1.34 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as lesion length at 40 mg/L after 48 hr compound at 25% WP (untreated control = 3.34 +/- 0.64 cm) Phytophthora sojae 0.62 cm
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as disease control efficacy at 4 mg/L after 48 hr compound at 25% WP relative to control Phytophthora sojae 45.52 %
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as disease control efficacy at 20 mg/L after 48 hr compound at 25% WP relative to control Phytophthora sojae 71.97 %
Antifungal activity against Phytophthora sojae race 1 in germinated soybean seeds assessed as disease control efficacy at 40 mg/L after 48 hr compound at 25% WP relative to control Phytophthora sojae 87.7 %
Induction of systemic acquired resistance against Sclerospora graminicola in Cenchrus americanus cultivar 7042S assessed as protection against downy mildew disease at 6 g/kg applied to seeds prior to sowing and to foliar of 7 day old seedling inoculated on day 2 measured on day 30 in field conditions (Rvb = 3%) Cenchrus americanus 92.0 %
Induction of systemic acquired resistance against Sclerospora graminicola in Cenchrus americanus cultivar 7042S assessed as protection against downy mildew disease at 6 g/kg applied to foliar of 7 day old seedling inoculated on day 2 measured on day 30 in field conditions (Rvb = 2%) Cenchrus americanus 91.0 %
Induction of systemic acquired resistance against Sclerospora graminicola in Cenchrus americanus cultivar 7042S assessed as protection against downy mildew disease at 6 g/kg applied to seeds prior to sowing followed by inoculation on 2 day old seedling measured on day 30 in field conditions (Rvb = 3%) Cenchrus americanus 92.0 %
Induction of systemic acquired resistance against Sclerospora graminicola in Cenchrus americanus cultivar 7042S assessed as protection against downy mildew disease at 6 g/kg applied to seeds prior to sowing followed by inoculation on 2 day old seedling measured on day 30 in green house condition(Rvb = 3%) Cenchrus americanus 92.0 %
Antifungal activity against Athelia rolfsii in tomato plants grown on fungal infested soil assessed as healthy tomato plants stands at 1.46 mL ai/150 cm3 of soil measured 35 days after transplanting Athelia rolfsii 90.3 ug ml-1
Antifungal activity against Athelia rolfsii in tomato plants grown on fungal infested soil assessed as healthy tomato plants stands at 0.728 mL ai/150 cm3 of soil measured 35 days after transplanting Athelia rolfsii 60.0 ug ml-1
Antifungal activity against Athelia rolfsii in tomato plants grown on fungal infested soil assessed as healthy tomato plants stands at 0.364 mL ai/150 cm3 of soil measured 35 days after transplanting Athelia rolfsii 34.3 ug ml-1
Antioomycete activity against Phytophthora capsici zoospores suspension infected in pepper plants (cv. Hanbyul) at first branch stage pre-exposed to compound spray on stems before fungal infection assessed as reduction in Phyophthora blight disease severity at 100 ug/mL under greenhouse conditions Phytophthora capsici None
Antioomycete activity against Phytophthora capsici zoospores suspension infected in pepper plants (cv. Hanbyul) at first branch stage pre-exposed to compound spray on stems before fungal infection assessed as reduction in Phyophthora blight disease severity at 1 to 1000 ug/mL under greenhouse conditions Phytophthora capsici None
Fungicidal activity against Fusarium culmorum assessed as inhibition of hyphal growth by radial growth test Fusarium culmorum 192.0 ug.mL-1
Fungicidal activity against Pythium debaryanum assessed as inhibition of hyphal growth by radial growth test Pythium debaryanum 211.0 ug.mL-1
Fungicidal activity against Rhizoctonia solani assessed as inhibition of hyphal growth by radial growth test Rhizoctonia solani 231.0 ug.mL-1
Fungicidal activity against Macrophomina phaseoli assessed as inhibition of hyphal growth by radial growth test Macrophomina phaseolina 173.0 ug.mL-1
Fungicidal activity against Phytophthora capsici Phytophthora capsici 1.5 ug.mL-1
Fungicidal activity against Pythium ultimum Pythium ultimum 0.6 ug.mL-1
Antifungal activity against Phytophthora capsici in pepper plants assessed as decrease in Phytophthora blight disease at 100 ug/ml Phytophthora capsici None
Antifungal activity against Phytophthora capsici in pepper plants assessed as decrease in Phytophthora blight disease at 50 ug/ml Phytophthora capsici None
Fungicidal activity against Diplodia mutila Q assessed as conidial germination inhibition after 48 hr Diplodia mutila 45.72 mgAi/L
Fungicidal activity against Diplodia mutila F (12)2 assessed as conidial germination inhibition after 48 hr Diplodia mutila 45.72 mgAi/L
Fungicidal activity against Diplodia mutila Iso-2 assessed as conidial germination inhibition after 48 hr Diplodia mutila 45.72 mgAi/L
Fungicidal activity against Neofusicoccum luteum N(12)2 assessed as conidial germination inhibition after 48 hr Neofusicoccum luteum 218.01 mgAi/L
Fungicidal activity against Neofusicoccum luteum M (13)8 assessed as conidial germination inhibition after 48 hr Neofusicoccum luteum 218.01 mgAi/L
Fungicidal activity against Neofusicoccum luteum G(s)-1 assessed as conidial germination inhibition after 48 hr Neofusicoccum luteum 218.01 mgAi/L
Fungicidal activity against Neofusicoccum australe J-3 assessed as conidial germination inhibition after 48 hr Neofusicoccum australe 113.11 mgAi/L
Fungicidal activity against Neofusicoccum australe Mel-2 assessed as conidial germination inhibition after 48 hr Neofusicoccum australe 113.11 mgAi/L
Fungicidal activity against Neofusicoccum australe Kat-1 assessed as conidial germination inhibition after 48 hr Neofusicoccum australe 113.11 mgAi/L
Fungicidal activity against Diplodia mutila Q assessed as mycelial growth inhibition after 48 hr Diplodia mutila 61.99 mgAi/L
Fungicidal activity against Diplodia mutila Iso-2 assessed as mycelial growth inhibition after 48 hr Diplodia mutila 61.99 mgAi/L
Fungicidal activity against Diplodia mutila F (12)2 assessed as mycelial growth inhibition after 48 hr Diplodia mutila 61.99 mgAi/L
Fungicidal activity against Neofusicoccum luteum M (13)8 assessed as mycelial growth inhibition after 48 hr Neofusicoccum luteum 188.0 mgAi/L
Fungicidal activity against Neofusicoccum luteum N(12)2 assessed as mycelial growth inhibition after 48 hr Neofusicoccum luteum 188.0 mgAi/L
Fungicidal activity against Neofusicoccum luteum G(s)-1 assessed as mycelial growth inhibition after 48 hr Neofusicoccum luteum 188.0 mgAi/L
Fungicidal activity against Neofusicoccum australe J-3 assessed as mycelial growth inhibition after 48 hr Neofusicoccum australe 102.6 mgAi/L
Fungicidal activity against Neofusicoccum australe Mel-2 assessed as mycelial growth inhibition after 48 hr Neofusicoccum australe 102.6 mgAi/L
Fungicidal activity against Neofusicoccum australe Kat-1 assessed as mycelial growth inhibition after 48 hr Neofusicoccum australe 102.6 mgAi/L
Growth inhibition of Phytophthora cactorum after 48 hr Phytophthora cactorum 0.013 ug.mL-1
Antifungal activity against Phytophthora katsurae assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora katsurae 0.46 ug.mL-1 Antifungal activity against Phytophthora katsurae assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora katsurae 100.0 ug.mL-1
Antifungal activity against Phytophthora megasperma assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora megasperma 0.34 ug.mL-1 Antifungal activity against Phytophthora megasperma assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora megasperma 100.0 ug.mL-1
Antifungal activity against Phytophthora porri IFO 30416 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora porri 0.08 ug.mL-1 Antifungal activity against Phytophthora porri IFO 30416 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora porri 3.0 ug.mL-1
Antifungal activity against Phytophthora nicotianae IFO 30595 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora nicotianae 0.08 ug.mL-1 Antifungal activity against Phytophthora nicotianae IFO 30595 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora nicotianae 3.0 ug.mL-1
Antifungal activity against Phytophthora cactorum IFO 30474 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora cactorum 0.3 ug.mL-1 Antifungal activity against Phytophthora cactorum IFO 30474 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora cactorum 0.03 ug.mL-1
Antifungal activity against Phytophthora palmivora IFO 30285 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora palmivora 0.54 ug.mL-1 Antifungal activity against Phytophthora palmivora IFO 30285 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora palmivora 3.0 ug.mL-1
Antifungal activity against Phytophthora capsici IFO 8386 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora capsici 0.62 ug.mL-1 Antifungal activity against Phytophthora capsici IFO 8386 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora capsici 3.0 ug.mL-1
Antifungal activity against phenylamide-resistant Phytophthora infestans 7-1 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 10.0 ug.mL-1 Antifungal activity against phenylamide-resistant Phytophthora infestans 7-1 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 10.0 ug.mL-1
Antifungal activity against Phytophthora infestans C-3 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 3.0 ug.mL-1 Antifungal activity against Phytophthora infestans C-3 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 0.15 ug.mL-1
Antifungal activity against Phytophthora infestans r0-3 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 0.21 ug.mL-1 Antifungal activity against Phytophthora infestans r0-3 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 10.0 ug.mL-1
Antifungal activity against Phytophthora infestans r1234-2 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 0.05 ug.mL-1 Antifungal activity against Phytophthora infestans r1234-2 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 10.0 ug.mL-1
Antifungal activity against Phytophthora infestans r1234 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 0.3 ug.mL-1 Antifungal activity against Phytophthora infestans r1234 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans 0.09 ug.mL-1
Antifungal activity against Phytophthora infestans TK-301 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans None Antifungal activity against Phytophthora infestans TK-301 assessed as inhibition of mycelial growth after 5 to 7 days Phytophthora infestans None

Cross References

Resources Reference
ChEMBL CHEMBL105809
FDA SRS 16K4M187IF
PubChem 42586
SureChEMBL SCHEMBL20990
CONTENTS