COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK049779
Chemical Name: (5Z)-3-ethyl-5-{[1-(4-nitrobenzyl)-1H-indol-3-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 423.52
Empirical Formula: C21H17N3O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.158
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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