COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019808
Chemical Name: 2-{[1-(4-ethoxy-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoicacid
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])N1C(=O)CC(C1=O)Sc1ccccc1C(=O)O

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Molecular Weight: 416.41
Empirical Formula: C19H16N2O7S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 2.458
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 3

     

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