COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081848
Chemical Name: (5E)-3-(3-nitrobenzyl)-5-(2,4,5-trimethoxybenzylidene)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(OC)c(cc1/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-])OC

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Molecular Weight: 430.44
Empirical Formula: C20H18N2O7S

Physical State: Dry powder
Available Amount: 83 mg

Lipinsky:
logP: 3.724
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 136
Number of rings: 3

     

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