COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379379
Chemical Name: (5E)-5-{2-[(2,4-dichlorobenzyl)oxy]-4-(diethylamino)benzylidene}-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: CCN(c1ccc(c(c1)OCc1ccc(cc1Cl)Cl)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-])CC

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Molecular Weight: 586.5
Empirical Formula: C28H25Cl2N3O5S

Physical State: Dry powder
Available Amount: 380 mg

Lipinsky:
logP: 8.377
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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