COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL120702
Chemical Name: 2-[(5E)-5-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioicacid
Smiles: COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/SC(=S)N(C1=O)C(C(=O)O)CC(=O)O

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Molecular Weight: 478.46
Empirical Formula: C19H14N2O9S2

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 3.109
Rotatable bonds: 9
H-donors: 2
H-acceptors: 9
PSA: 220
Number of rings: 3

     

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