COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047462
Chemical Name: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-fluoro-1,3-benzothiazol-2-yl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cccc(c2)OC)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)F)/O

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Molecular Weight: 504.54
Empirical Formula: C27H21FN2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.073
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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