COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004025
Chemical Name: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 440.48
Empirical Formula: C21H20N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.308
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 4

     

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