COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419359
Chemical Name: (5E)-5-[3-bromo-4-(dimethylamino)benzylidene]-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc(c(c2)Br)N(C)C)/C(=O)N1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 464.36
Empirical Formula: C18H14BrN3O3S2

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 5.885
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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