COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155064
Chemical Name: methyl2-{(5E)-5-[3-bromo-4-(dimethylamino)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: COC(=O)C(N1C(=O)S/C(=C/c2ccc(c(c2)Br)N(C)C)/C1=O)C

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Molecular Weight: 413.29
Empirical Formula: C16H17BrN2O4S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.717
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 92
Number of rings: 2

     

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