COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157053
Chemical Name: (2E,5E)-5-[3-bromo-4-(dimethylamino)benzylidene]-2-[(4-ethoxyphenyl)imino]-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C/1\NC(=O)/C(=C\c2ccc(c(c2)Br)N(C)C)/S1

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Molecular Weight: 446.37
Empirical Formula: C20H20BrN3O2S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.45
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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