COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL334156
Chemical Name: (2E,5E)-5-(3-nitrobenzylidene)-3-(prop-2-en-1-yl)-2-(prop-2-en-1-ylimino)-1,3-thiazolidin-4-one
Smiles: C=CCN1/C(=N\CC=C)/S/C(=C/c2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 329.38
Empirical Formula: C16H15N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.354
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 103
Number of rings: 2

     

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