Table 1 Informatic analysis results using Osiris (https://www.organic-chemistry.org/prog/peo/) and Molinspiration (https://www.molinspiration.com, Slovensky Grob, Slovakia) software.

From: Synthesis of new series of quinoline derivatives with insecticidal effects on larval vectors of malaria and dengue diseases

Properties

Compound

 

N1-(7-chloro quinoline -4-yl) ethane-1,2-diamine

Molecular weight (g/mol)

221

LogP

1.31

LogS

− 2.99

TPSA

50.94

GPCR ligand

− 0.01

Ion channel modulator

0.42

Kinase inhibitor

0.41

Nuclear receptor ligand

− 0.92

Protease inhibitor

− 0.22

Enzyme inhibitor

0.24

Mutagenic

3

Tumorigenic

1

Irritant

1

Reproductive effect

1

Druglikeness

− 1.35

  1. The toxicity risk is expressed considering the following number code: (1) no risk (2) medium risk (3) high risk.
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