COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839340
Chemical Name: (5E)-5-(4-methoxybenzylidene)-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 424.48
Empirical Formula: C21H20N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.025
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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