COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418676
Chemical Name: (5E)-3-(4-nitrophenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C(=O)N1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 453.46
Empirical Formula: C20H11N3O6S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.143
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 182
Number of rings: 4

     

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