PROPICONAZOLE

/static/temp/default.svg Search structure
Synonyms
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 STJLVHWMYQXCPB-UHFFFAOYSA-N
Smiles CCCC1COC(Cn2cncn2)(O1)c3ccc(Cl)cc3Cl
InChI
InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H17Cl2N3O2
Molecular Weight 342.22
AlogP 3.8
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 49.17
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 22.0
Assay Description Organism Bioactivity Reference
Fungicidal activity against Botryotinia fuckeliana assessed as growth inhibition at 50 ug/ml after 2 days Botryotinia fuckeliana 100.0 %
Fungicidal activity against Fusarium graminearum assessed as growth inhibition at 50 ug/ml after 2 days Fusarium graminearum 100.0 %
Fungicidal activity against Botryosphaeria berengeriana assessed as growth inhibition at 50 ug/ml after 2 days Botryosphaeria berengeriana 100.0 %
Fungicidal activity against Mycosphaerella arachidis assessed as growth inhibition at 50 ug/ml after 2 days Mycosphaerella arachidis 100.0 %
Fungicidal activity against Alternaria solani assessed as growth inhibition at 50 ug/ml after 2 days Alternaria solani 89.19 %
Phytotoxicity in Capsicum annuum (pepper) at 0.1% applied as spray Capsicum annuum None
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length measured per plot at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8 to 8.7 cm) Colletotrichum capsici 8.5 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length measured per plot at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8 to 8.7 cm) Colletotrichum capsici 9.2 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length measured per plot at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8 to 8.7 cm) Colletotrichum capsici 10.2 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit yield measured per plot at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8.25 to 9.3 kg) Colletotrichum capsici 9.86 Kg
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit yield measured per plot at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8.25 to 9.3 kg) Colletotrichum capsici 13.1 Kg
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit yield measured per plot at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 8.25 to 9.3 kg) Colletotrichum capsici 17.5 Kg
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 51 to 56.5%) Colletotrichum capsici 30.6 %
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 51 to 56.5%) Colletotrichum capsici 20.5 %
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in field conditions (Rvb = 51 to 56.5%) Colletotrichum capsici 13.5 %
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 6.8 to 7 cm) Colletotrichum capsici 7.1 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 6.8 to 7 cm) Colletotrichum capsici 7.8 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit length at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 6.8 to 7 cm) Colletotrichum capsici 8.0 cm
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit mass measured per pot at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 85.3 to 94.5 g) Colletotrichum capsici 112.8 g
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit mass measured per pot at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 85.3 to 94.5 g) Colletotrichum capsici 130.0 g
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as fruit mass measured per pot at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 85.3 to 94.5 g) Colletotrichum capsici 165.6 g
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.025% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 62.5 to 68.6%) Colletotrichum capsici 33.0 %
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.05% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 62.5 to 68.6%) Colletotrichum capsici 25.7 %
Fungicidal activity against Colletotrichum capsici infected chilli plant assessed as percent disease index at 0.1% applied as spray on day 10 post inoculation and twice every 20 days measured on day 155 post sowing in green house conditions (Rvb = 62.5 to 68.6%) Colletotrichum capsici 17.5 %
Fungicidal activity against Colletotrichum capsici assessed as reduction of cellulase production at 1 ug/ml measured per mg of protein per min incubated for 10 days by spectrophotometric analysis in presence of dinitrosalicyclic acid (Rvb = 0.19 mg) Colletotrichum capsici 0.05 %
Fungicidal activity against Colletotrichum capsici assessed as reduction of pectin trans-eliminase production at 1 ug/ml incubated for 10 days measured up to 120 min by Ostwald-Fenske viscometric analysis (Rvb = 38.5%) Colletotrichum capsici 12.0 %
Fungicidal activity against Colletotrichum capsici assessed as reduction of polygalacturonase trans-eliminase production at 1 ug/ml incubated for 10 days measured up to 120 min by Ostwald-Fenske viscometric analysis (Rvb = 40.8%) Colletotrichum capsici 8.5 %
Fungicidal activity against Puccinia allii assessed as inhibition of spore germination Puccinia allii 50.0 ug.mL-1
Fungicidal activity against Colletotrichum capsici assessed as reduction of polygalacturonase production at 1 ug/ml incubated for 10 days measured up to 120 min by Ostwald-Fenske viscometric analysis (Rvb = 45.3%) Colletotrichum capsici 9.2 %
Fungicidal activity against Colletotrichum capsici assessed as inhibition of mycelial growth Colletotrichum capsici 0.19 ug ml-1
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 50 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 0.0 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 25 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 0.0 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 10 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 0.0 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 5 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 0.0 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 1 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 0.33 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 0.5 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 1.3 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as sporulation at 0.1 ug/ml incubated 16 hr photoperiod for 20 days by haemocytometer (Rvb = 0.081 x 10'6 ml'-1) Colletotrichum capsici 2.83 10'6/ml
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 50 ug/ml after 48 to 96 hr (Rvb = 70.2 CFU) Colletotrichum capsici 0.0
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 10 ug/ml after 48 to 96 hr (Rvb = 70.2 CFU) Colletotrichum capsici 0.0
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 25 ug/ml after 48 to 96 hr (Rvb = 70.2 CFU) Colletotrichum capsici 0.0
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 1 ug/ml after 48 to 96 hr (Rvb = 70.2 CFU) Colletotrichum capsici 3.3
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 0.5 ug/ml after 48 to 96 hr (Rvb = 70.2 CFU) Colletotrichum capsici 15.5
Fungicidal activity against Colletotrichum capsici assessed as spore germination at 5 ug/ml after 48 to 96 hr relative to control Colletotrichum capsici 0.0 %
Fungicidal activity against Colletotrichum capsici assessed as inhibition of spore germination at 0.1 ug/ml after 48 to 96 hr relative to control Colletotrichum capsici 62.0 %
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 25 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 0.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 50 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 0.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 10 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 0.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 5 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 53.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 1 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 129.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 0.5 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 240.0 mg
Fungicidal activity against Colletotrichum capsici assessed as mycelial biomass at 0.1 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 675 mg) Colletotrichum capsici 410.0 mg
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 50 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 9.0 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 25 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 9.0 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 5 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 12.61 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 10 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 9.0 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 1 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 20.5 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 0.5 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 39.2 mm
Fungicidal activity against Colletotrichum capsici assessed as linear growth at 0.1 ug/ml incubated 16 hr photoperiod for 20 days (Rvb = 90 mm) Colletotrichum capsici 55.3 mm
Antifungal activity against Fusarium oxysporum f. sp. cubense race 4 infected in Cavendish banana plant assessed as reduction in disease severity at 25 ug a.i./ml applied as soil drench treatment 1 week after planting measured after 7 weeks in greenhouse conditions Fusarium oxysporum f. sp. cubense race 4 52.8 %
Antifungal activity against Fusarium oxysporum f. sp. cubense race 4 infected in Cavendish banana plant assessed as reduction in disease severity at 25 ug a.i./ml applied as soil drench treatment immediately after planting measured after 7 weeks in greenhouse conditions Fusarium oxysporum f. sp. cubense race 4 44.4 %
Antifungal activity against Fusarium oxysporum f. sp. cubense race 4 infected in Cavendish banana plant assessed as reduction in disease severity at 25 ug a.i./ml applied as root dip treatment for 10 min measured after 7 weeks in greenhouse conditions Fusarium oxysporum f. sp. cubense race 4 75.0 %
Phytotoxicity against Chinese Musa acuminata AAA Group (Cavendish banana) at 5 to 25 ug a.i./ml relative to control Musa acuminata AAA Group None
Growth inhibition of Fusarium oxysporum f. sp. cubense race 4 isolate CAV 031 at 100 ug/ml after 7 days Fusarium oxysporum f. sp. cubense race 4 None
Phytotoxicity against Chinese Musa acuminata AAA Group (Cavendish banana) at 50 ug a.i./ml relative to control Musa acuminata AAA Group None
Growth inhibition of Fusarium oxysporum f. sp. cubense race 4 isolate CAV 086 at 5 ug/ml after 7 days Fusarium oxysporum f. sp. cubense race 4 None
Fungicidal activity against Monilinia fructicola isolate GADL193.04 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL193.04 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL133.04 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL133.04 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate SCDL71.01 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate SCDL71.01 infected peach fruit assessed as decrease in sporulation area at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL193.04 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate SCDL71.01 assessed as reduction in colony diameter after 5 days Monilinia fructicola 0.023 uL/ml
Fungicidal activity against Monilinia fructicola isolate GADL133.04 assessed as reduction in colony diameter after 5 days Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL193.04 assessed as reduction in colony diameter after 5 days Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate SCDL71.01 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate SCDL71.01 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL133.04 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL193.04 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr prior to inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Monilinia fructicola isolate GADL133.04 infected peach fruit assessed as decrease in brown rot disease incidence at 0.131 ml/l applied 24 hr after inoculation after 5 days relative to untreated-control Monilinia fructicola None
Fungicidal activity against Rhizoctonia solani assessed as inhibition rate of circle mycelium growth at 100 ug/ml relative to control Rhizoctonia solani 40.0 %
Fungicidal activity against Rhizoctonia solani assessed as inhibition rate of circle mycelium growth at 200 ug/ml relative to control Rhizoctonia solani 60.0 %
Fungicidal activity against Rhizoctonia solani assessed as inhibition rate of circle mycelium growth at 400 ug/ml relative to control Rhizoctonia solani 90.0 %
Fungicidal activity against Rhizoctonia solani assessed as inhibition rate of circle mycelium growth at 500 ug/ml Rhizoctonia solani 90.0 %
Fungicidal activity against Ustilaginoidea oryzae assessed as inhibition rate of circle mycelium growth at 500 ug/ml Ustilaginoidea 0.0 %
Fungicidal activity against Alternaria alternata assessed as inhibition rate of circle mycelium growth at 500 ug/ml Alternaria alternata 0.0 %
Fungicidal activity against Phytophthora capsici assessed as inhibition rate of circle mycelium growth at 500 ug/ml Phytophthora capsici 0.0 %
Fungicidal activity against Fusarium graminearum assessed as inhibition rate of circle mycelium growth at 500 ug/ml Fusarium graminearum 0.0 %
Fungicidal activity against Botryotinia fuckeliana assessed as inhibition rate of circle mycelium growth at 500 ug/ml Botryotinia fuckeliana 0.0 %
Fungicidal activity against Sclerotinia sclerotiorum assessed as inhibition rate of circle mycelium growth at 500 ug/ml Sclerotinia sclerotiorum 87.5 %

Cross References

Resources Reference
ChEMBL CHEMBL560579
PubChem 43234
SureChEMBL SCHEMBL21081
CONTENTS