COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053199
Chemical Name: (5E)-5-[4-(diethylamino)benzylidene]-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCN(c1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])CC

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Molecular Weight: 465.58
Empirical Formula: C24H27N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.168
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 4

     

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