COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378849
Chemical Name: (5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl

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Molecular Weight: 498.9
Empirical Formula: C23H15ClN2O7S

Physical State: Dry powder
Available Amount: 745 mg

Lipinsky:
logP: 6.238
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 140
Number of rings: 5

     

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