COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428123
Chemical Name: [(5E)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)[N+](=O)[O-])C)/C1=O

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Molecular Weight: 404.42
Empirical Formula: C17H12N2O6S2

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 3.075
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 173
Number of rings: 3

     

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