nuarimol

Identification (Source:EPA,EU)

ID 681
Name nuarimol
CAS 63284-71-9
IUPAC
Inchi InChI=1S/C17H12ClFN2O/c18-16-4-2-1-3-15(16)17(22,13-9-20-11-21-10-13)12-5-7-14(19)8-6-12/h1-11,22H
CIPAC 443
EPA Code 224100
Formula C17H12ClFN2O
SMILES Fc1ccc(cc1)C(O)(c2ccccc2Cl)c3cncnc3
Status Not Approved

Classification

Mode of Action Systemic with curative and protective action
Pesticide Type Fungicide
Chemical Group Pyrimidine
Classification pyrimidine fungicides

Properties (Source:PubChem)

Molecular Weight 314.7
Physical State Colourless crystals
AlogP 3.368
H-Bond Donor 1
H-Bond Acceptor 3
Surface Area 286.68
Polar Surface Area 46.01

Structure



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3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Algae Acute 72 hour EC50, growth 2.5 mg l-1
Aquatic invertebrates Acute 48 hour EC50 25 mg l-1
Birds Acute LD50 200 mg kg-1
Earthworms Acute 14 day LD50 100000 mg kg-1
Fish Acute 96 hour LC50 12.1 mg l-1
Honeybees Acute 48 hour LD50 21.6 μg bee-1
Mammals Acute oral LD50 1250 mg kg-1
Mammals Short term dietary NOEL 50 ppm diet

Related targets

Target Name RScore (About this table)
protein as 31(0,1,1,1) Details
GTPase 19(0,0,3,4) Details
G 6 pase 18(0,0,3,3) Details
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Node List

ID Name Type

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