COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK963740
Chemical Name: 4-[(5E)-5-{5-bromo-2-[(4-tert-butylbenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C/c2cc(Br)ccc2OCc2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 548.52
Empirical Formula: C25H26BrNO4S2

Available Amount: 0 mg

Lipinsky:
logP: 6.333
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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