binapacryl

Identification (Source:EPA,EU)

ID 144
Name binapacryl
CAS 485-31-4
IUPAC
Inchi InChI=1S/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3
CIPAC 138
EPA Code 012201
Formula C15H18N2O6
SMILES O=C(Oc1c(cc(cc1C(C)CC)[N+]([O-])=O)[N+]([O-])=O)\C=C(/C)C
Status Not Approved

Classification

Mode of Action Non-systemic. As a miticide it works with ovicidal action. Respiration inhibitor.
Pesticide Type Fungicide, Insecticide, Miticide
Chemical Group Dinitrophenol
Classification dinitrophenol fungicides
dinitrophenol acaricides

Properties (Source:PubChem)

Molecular Weight 322.31
Physical State Colourless to brownish crystalline powder
AlogP 4.583
H-Bond Donor 0
H-Bond Acceptor 6
Surface Area 334.52
Polar Surface Area 117.94

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
Birds Acute LD50 800 mg kg-1
Fish Acute 96 hour LC50 0.05 mg l-1
Mammals Acute oral LD50 58 mg kg-1
Bio-concentration factor CT50 Not available days

Related targets

Target Name RScore (About this table)
xanthine oxidase 1(0,0,0,1) Details
cytochrome P450 (protein family or complex) 1(0,0,0,1) Details
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