COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380158
Chemical Name: (5Z)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-3-(2-cyclohexylethyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)CCC2CCCCC2)cc(c1O)Br

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Molecular Weight: 456.42
Empirical Formula: C19H22BrNO3S2

Physical State: Dry powder
Available Amount: 1387 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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