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. 2021 Jun 24;36(1):1378–1386. doi: 10.1080/14756366.2021.1928111

Table 3.

In silico toxicity prediction for 5-FU, 1, and 3.

Compd. Toxicity predictiona
Mutagenic Tumorigenic Irritant Reproductive Effects
5-FU high high high high
1b none none none none
3 none none none none

aProperties were predicted using DataWarrior software49.

bData from reference34.