COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546534
Chemical Name: 4-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)O

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Molecular Weight: 435.61
Empirical Formula: C22H29NO4S2

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 5.556
Rotatable bonds: 12
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 2

     

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