COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509367
Chemical Name: 2-{[4-(4-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Smiles: Cc1ccc(cc1)c1nc(SCC(=O)c2cccc(c2)[N+](=O)[O-])nc(c1)C(F)(F)F

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Molecular Weight: 433.41
Empirical Formula: C20H14F3N3O3S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 6.052
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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