COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152689
Chemical Name: (5E)-5-[3,5-dibromo-4-(prop-2-en-1-yloxy)benzylidene]-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: C=CCOc1c(Br)cc(cc1Br)/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 554.22
Empirical Formula: C20H14Br2N2O5S

Physical State: Dry powder
Available Amount: 485 mg

Lipinsky:
logP: 5.931
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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