COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383031
Chemical Name: (5Z)-5-{2-[(4-bromobenzyl)oxy]-3-methoxybenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\c2cccc(c2OCc2ccc(cc2)Br)OC)/C1=O

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Molecular Weight: 476.41
Empirical Formula: C21H18BrNO3S2

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 5.049
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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