COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358172
Chemical Name: (5E)-5-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C/c2cn(c3c2cccc3)Cc2ccccc2Cl)/C(=O)N1Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 503.97
Empirical Formula: C26H18ClN3O4S

Physical State: Dry powder
Available Amount: 727 mg

Lipinsky:
logP: 6.584
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 5

     

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