COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564491
Chemical Name: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccco2)\O)/C(=O)C1=O

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Molecular Weight: 465.42
Empirical Formula: C22H12FN3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.032
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 157
Number of rings: 5

     

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