COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357947
Chemical Name: (5E)-5-[(2-butoxynaphthalen-1-yl)methylidene]-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: CCCCOc1ccc2c(c1/C=C\1/SC(=O)N(C1=O)Cc1ccccc1[N+](=O)[O-])cccc2

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Molecular Weight: 462.53
Empirical Formula: C25H22N2O5S

Physical State: Dry powder
Available Amount: 1336 mg

Lipinsky:
logP: 6.791
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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