COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038892
Chemical Name: (5Z)-5-(4-bromobenzylidene)-3-(2,3,4,6-tetra-O-acetylhexopyranosyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(=O)OCC1OC(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)N1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=O

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Molecular Weight: 630.49
Empirical Formula: C24H24BrNO10S2

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.432
Rotatable bonds: 10
H-donors: 0
H-acceptors: 10
PSA: 192
Number of rings: 3

     

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