COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152688
Chemical Name: 2-[(2-ethoxy-4-{(E)-[3-(3-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 515.55
Empirical Formula: C27H21N3O6S

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 5.412
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 150
Number of rings: 4

     

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