thiocyclam

Identification (Source:EPA,EU)

ID 1453
Name thiocyclam
CAS 31895-21-3
IUPAC
Inchi InChI=1S/C5H11NS3/c1-6(2)5-3-7-9-8-4-5/h5H,3-4H2,1-2H3
CIPAC 542
EPA Code
Formula C5H11NS3
SMILES S1SSCC(N(C)C)C1
Status Not Approved

Classification

Mode of Action A nereistoxin analogue insecticide. Selective, stomach acting with some contact action. Acetylcholine receptor (nAChR) agonist.
Pesticide Type Insecticide
Chemical Group Unclassified
Classification nereistoxin analogue insecticides

Properties (Source:PubChem)

Molecular Weight 181.3
Physical State White solid
AlogP 1.962
H-Bond Donor 0
H-Bond Acceptor 4
Surface Area 178.34
Polar Surface Area 79.14

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

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 3.3 mg l-1
Aquatic invertebrates Acute 48 hour EC50 2.01 mg l-1
Earthworms Acute 14 day LD50 87 mg kg-1
Fish Acute 96 hour LC50 0.04 mg l-1
Mammals Acute oral LD50 370 mg kg-1
Mammals Short term dietary NOEL 100 ppm diet

Related targets

Target Name RScore (About this table)
cytochrome P450 (protein family or complex) 87(1,1,1,7) Details
Docunmentation of Network Visuallization

Network initializing...Please wait

Node List

ID Name Type

Legend:

: Current entry node; : Target node; : Compound node;