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. 2022 Jul 13;12(8):170. doi: 10.1007/s13205-022-03236-w

Table 2.

TOPKAT module of Accelrys Discovery studio 3.0-predicted toxicity risks of the titled compounds 3(a-j)

Compound code Mouse female
NTP carcinogen
Mouse male
NTP carcinogen
Rat male NTP
carcinogen
Ames mutagen Skin irritancy
3a  −   −   −   −   − 
3b  −   −   −   −   − 
3c  −   −   −   −   − 
3d  −   −   −   −   − 
3e  −   −   −   −   − 
3f  −   −   −   −   − 
3g  −   −   −   −   − 
3h  −   −   −   −   − 
3i  −   −   −   −   − 
3j  −   −   −   −   − 

The negative symbol ( −) indicates absence of any toxicity risk, such as carcinogenicity, Ames mutagenicity and skin irritancy