COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369959
Chemical Name: (5Z)-5-{4-[(3,4-dichlorobenzyl)oxy]-3,5-diiodobenzylidene}-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C\c2cc(I)c(c(c2)I)OCc2ccc(c(c2)Cl)Cl)/C(=O)N1Cc1ccccc1[N+](=O)[O-]

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Molecular Weight: 767.17
Empirical Formula: C24H14Cl2I2N2O5S

Physical State: Dry powder
Available Amount: 743 mg

Lipinsky:
logP: 8.459
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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