diclobutrazol

Identification (Source:EPA,EU)

ID 528
Name diclobutrazol
CAS 75736-33-3
IUPAC
Inchi InChI=1S/2C15H19Cl2N3O/c2*1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h2*4-5,7-9,13-14,21H,6H2,1-3H3/t2*13-,14+/m10/s1
CIPAC 421
EPA Code
Formula C15H19Cl2N3O
SMILES Clc1ccc(c(Cl)c1)CC(n2ncnc2)C(O)C(C)(C)C
Status Not Approved

Classification

Mode of Action Systemic, absorbed through leaves, stem and roots and translocated. Known to block fungal sterol biosynthesis.
Pesticide Type Fungicide, Bactericide, Wood preservative
Chemical Group Conazole
Classification conazole fungicides (triazoles)

Properties (Source:PubChem)

Molecular Weight 328.24
Physical State
AlogP 4.012
H-Bond Donor 1
H-Bond Acceptor 3
Surface Area 326.95
Polar Surface Area 50.94

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 9000 mg kg-1
Fish Acute 96 hour LC50 9.6 mg l-1
Mammals Acute oral LD50 > 4000 mg kg-1

Related targets

Target Name RScore (About this table)
CYP51 34(0,1,1,4) Details
CYP3A4 34(0,1,1,4) Details
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