COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371597
Chemical Name: (5Z)-5-{2-bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C\c2cc(OC)c(cc2Br)OCc2ccc(cc2)C)/C1=O

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Molecular Weight: 478.43
Empirical Formula: C21H20BrNO3S2

Physical State: Dry powder
Available Amount: 984 mg

Lipinsky:
logP: 5.494
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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