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. 2018 May 18;23(5):1209. doi: 10.3390/molecules23051209

Table 6.

In silico toxicity parameters for molecules 2 and 3 a.

Compound Mutagenic Tumorigenic Reproductive Effects Irritant Drug-Likeness Drug-Score
2 none none None none 2.90 0.78
3 none none None none 5.03 0.91
4 none none None none 5.10 0.93

a The properties related to toxicity were predicted using DataWarrior software.