COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009130
Chemical Name: butyl4-[(5Z)-5-{4-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1C(=S)S/C(=C\c2ccc(cc2)OCCOc2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 589.78
Empirical Formula: C33H35NO5S2

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 9.338
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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